Prenol lipids
Filtered Search Results
Pulegone, 92%, pract.
CAS: 89-82-7 Molecular Formula: C10H16O Molecular Weight (g/mol): 152.24 MDL Number: MFCD00063000 InChI Key: NZGWDASTMWDZIW-QMMMGPOBSA-N Synonym: --pulegone,s---pulegone,pulegone,-,unii-hl7z89m60h,cyclohexanone, 5-methyl-2-1-methylethylidene-, s,s-p-menth-4 8-en-3-one,s-2-isopropylidene-5-methylcyclohexanone,5s-5-methyl-2-propan-2-ylidenecyclohexan-1-one PubChem CID: 638012 ChEBI: CHEBI:81226 IUPAC Name: (5S)-5-methyl-2-propan-2-ylidenecyclohexan-1-one SMILES: CC1CCC(=C(C)C)C(=O)C1
| PubChem CID | 638012 |
|---|---|
| CAS | 89-82-7 |
| Molecular Weight (g/mol) | 152.24 |
| ChEBI | CHEBI:81226 |
| MDL Number | MFCD00063000 |
| SMILES | CC1CCC(=C(C)C)C(=O)C1 |
| Synonym | --pulegone,s---pulegone,pulegone,-,unii-hl7z89m60h,cyclohexanone, 5-methyl-2-1-methylethylidene-, s,s-p-menth-4 8-en-3-one,s-2-isopropylidene-5-methylcyclohexanone,5s-5-methyl-2-propan-2-ylidenecyclohexan-1-one |
| IUPAC Name | (5S)-5-methyl-2-propan-2-ylidenecyclohexan-1-one |
| InChI Key | NZGWDASTMWDZIW-QMMMGPOBSA-N |
| Molecular Formula | C10H16O |
(R)-(-)-Flurbiprofen, 97%
CAS: 51543-40-9 Molecular Formula: C15H13FO2 Molecular Weight (g/mol): 244.27 MDL Number: MFCD00869714 InChI Key: SYTBZMRGLBWNTM-SNVBAGLBSA-N Synonym: tarenflurbil,r-flurbiprofen,flurizan,r-2-flurbiprofen,unii-501w00oowa,r-2-flubiprofen,r---flurbiprofen,--2r-2-2-fluorobiphenyl-4-yl propanoic acid,r---2-fluoro-alpha-methyl-4-biphenylacetic acid PubChem CID: 92337 ChEBI: CHEBI:38666 IUPAC Name: (2R)-2-(3-fluoro-4-phenylphenyl)propanoic acid SMILES: CC(C1=CC(=C(C=C1)C2=CC=CC=C2)F)C(=O)O
| PubChem CID | 92337 |
|---|---|
| CAS | 51543-40-9 |
| Molecular Weight (g/mol) | 244.27 |
| ChEBI | CHEBI:38666 |
| MDL Number | MFCD00869714 |
| SMILES | CC(C1=CC(=C(C=C1)C2=CC=CC=C2)F)C(=O)O |
| Synonym | tarenflurbil,r-flurbiprofen,flurizan,r-2-flurbiprofen,unii-501w00oowa,r-2-flubiprofen,r---flurbiprofen,--2r-2-2-fluorobiphenyl-4-yl propanoic acid,r---2-fluoro-alpha-methyl-4-biphenylacetic acid |
| IUPAC Name | (2R)-2-(3-fluoro-4-phenylphenyl)propanoic acid |
| InChI Key | SYTBZMRGLBWNTM-SNVBAGLBSA-N |
| Molecular Formula | C15H13FO2 |
alpha-Terpineol, 95%, mixture of alpha- and gamma-terpineol
CAS: 98-55-5 Molecular Formula: C10H18O Molecular Weight (g/mol): 154.25 MDL Number: MFCD00001557 InChI Key: WUOACPNHFRMFPN-UHFFFAOYSA-N Synonym: alpha-terpineol,terpineol,p-menth-1-en-8-ol,2-4-methylcyclohex-3-en-1-yl propan-2-ol,dl-alpha-terpineol,1-p-menthen-8-ol,1-menthene-8-ol,terpineol schlechthin,carvomenthenol,terpenol PubChem CID: 17100 ChEBI: CHEBI:22469 IUPAC Name: 2-(4-methylcyclohex-3-en-1-yl)propan-2-ol SMILES: CC1=CCC(CC1)C(C)(C)O
| PubChem CID | 17100 |
|---|---|
| CAS | 98-55-5 |
| Molecular Weight (g/mol) | 154.25 |
| ChEBI | CHEBI:22469 |
| MDL Number | MFCD00001557 |
| SMILES | CC1=CCC(CC1)C(C)(C)O |
| Synonym | alpha-terpineol,terpineol,p-menth-1-en-8-ol,2-4-methylcyclohex-3-en-1-yl propan-2-ol,dl-alpha-terpineol,1-p-menthen-8-ol,1-menthene-8-ol,terpineol schlechthin,carvomenthenol,terpenol |
| IUPAC Name | 2-(4-methylcyclohex-3-en-1-yl)propan-2-ol |
| InChI Key | WUOACPNHFRMFPN-UHFFFAOYSA-N |
| Molecular Formula | C10H18O |
(-)-8-Phenylmenthol, 97%, Thermo Scientific Chemicals
CAS: 65253-04-5 MDL Number: MFCD00010501 InChI Key: WTQIZFCJMGWUGZ-BPLDGKMQSA-N Synonym: --8-phenylmenthol,--phenmenthol,1r,2s,5r-5-methyl-2-2-phenylpropan-2-yl cyclohexanol,cyclohexanol, 5-methyl-2-1-methyl-1-phenylethyl-, 1r,2s,5r,1r,2s,5r-5-methyl-2-2-phenylpropan-2-yl cyclohexan-1-ol,1r,2s,5r-5-methyl-2-1-methyl-1-phenylethyl cyclohexanol,cyclohexanol,5-methyl-2-1-methyl-1-phenylethyl-, 1r,2s,5r PubChem CID: 2725001 IUPAC Name: (1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexan-1-ol SMILES: CC1CCC(C(C1)O)C(C)(C)C2=CC=CC=C2
| PubChem CID | 2725001 |
|---|---|
| CAS | 65253-04-5 |
| MDL Number | MFCD00010501 |
| SMILES | CC1CCC(C(C1)O)C(C)(C)C2=CC=CC=C2 |
| Synonym | --8-phenylmenthol,--phenmenthol,1r,2s,5r-5-methyl-2-2-phenylpropan-2-yl cyclohexanol,cyclohexanol, 5-methyl-2-1-methyl-1-phenylethyl-, 1r,2s,5r,1r,2s,5r-5-methyl-2-2-phenylpropan-2-yl cyclohexan-1-ol,1r,2s,5r-5-methyl-2-1-methyl-1-phenylethyl cyclohexanol,cyclohexanol,5-methyl-2-1-methyl-1-phenylethyl-, 1r,2s,5r |
| IUPAC Name | (1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexan-1-ol |
| InChI Key | WTQIZFCJMGWUGZ-BPLDGKMQSA-N |
D(+)-Fenchone, 97%
CAS: 4695-62-9 Molecular Formula: C10H16O Molecular Weight (g/mol): 152.24 MDL Number: MFCD00070689 InChI Key: LHXDLQBQYFFVNW-XCBNKYQSSA-N Synonym: +-fenchone,1s-1,3,3-trimethylbicyclo 2.2.1 heptan-2-one,1s-1,3,3-trimethyl-norbornan-2-one PubChem CID: 1201521 ChEBI: CHEBI:165 IUPAC Name: (1R,4S)-2,2,4-trimethylbicyclo[2.2.1]heptan-3-one SMILES: CC1(C2CCC(C2)(C1=O)C)C
| PubChem CID | 1201521 |
|---|---|
| CAS | 4695-62-9 |
| Molecular Weight (g/mol) | 152.24 |
| ChEBI | CHEBI:165 |
| MDL Number | MFCD00070689 |
| SMILES | CC1(C2CCC(C2)(C1=O)C)C |
| Synonym | +-fenchone,1s-1,3,3-trimethylbicyclo 2.2.1 heptan-2-one,1s-1,3,3-trimethyl-norbornan-2-one |
| IUPAC Name | (1R,4S)-2,2,4-trimethylbicyclo[2.2.1]heptan-3-one |
| InChI Key | LHXDLQBQYFFVNW-XCBNKYQSSA-N |
| Molecular Formula | C10H16O |
Crocetin, free acid, >90%, MP Biomedicals™
CAS: 27876-94-4 Molecular Formula: C20H24O4 Molecular Weight (g/mol): 328.408 InChI Key: PANKHBYNKQNAHN-MQQNZMFNSA-N Synonym: crocetin,trans-crocetin,8,8'-diapocarotenedioic acid,natural yellow 6,8,8'-diapocarotene-8,8'-dioic acid,8,8'-diapo-psi,psi-carotenedioic acid,ccris 7484,unii-20tc155l9c,2e,4e,6e,8e,10e,12e,14e-2,6,11,15-tetramethylhexadeca-2,4,6,8,10,12,14-heptaenedioic acid,.alpha.-crocetin PubChem CID: 5281232 ChEBI: CHEBI:3918 IUPAC Name: (2E,4E,6E,8E,10E,12E,14E)-2,6,11,15-tetramethylhexadeca-2,4,6,8,10,12,14-heptaenedioic acid SMILES: CC(=CC=CC=C(C)C=CC=C(C)C(=O)O)C=CC=C(C)C(=O)O
| PubChem CID | 5281232 |
|---|---|
| CAS | 27876-94-4 |
| Molecular Weight (g/mol) | 328.408 |
| ChEBI | CHEBI:3918 |
| SMILES | CC(=CC=CC=C(C)C=CC=C(C)C(=O)O)C=CC=C(C)C(=O)O |
| Synonym | crocetin,trans-crocetin,8,8'-diapocarotenedioic acid,natural yellow 6,8,8'-diapocarotene-8,8'-dioic acid,8,8'-diapo-psi,psi-carotenedioic acid,ccris 7484,unii-20tc155l9c,2e,4e,6e,8e,10e,12e,14e-2,6,11,15-tetramethylhexadeca-2,4,6,8,10,12,14-heptaenedioic acid,.alpha.-crocetin |
| IUPAC Name | (2E,4E,6E,8E,10E,12E,14E)-2,6,11,15-tetramethylhexadeca-2,4,6,8,10,12,14-heptaenedioic acid |
| InChI Key | PANKHBYNKQNAHN-MQQNZMFNSA-N |
| Molecular Formula | C20H24O4 |
Terpineol, Practical, Spectrum™ Chemical
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CAS: 8000-41-7 Molecular Weight (g/mol): 154.24 g/mol
| CAS | 8000-41-7 |
|---|---|
| Molecular Weight (g/mol) | 154.24 g/mol |
Menthofuran, 95%
CAS: 494-90-6 Molecular Formula: C10H14O Molecular Weight (g/mol): 150.22 MDL Number: MFCD00041851 InChI Key: YGWKXXYGDYYFJU-UHFFFAOYSA-N Synonym: menthofuran,menthofurane,3,9-epoxy-p-mentha-3,8-diene,benzofuran, 4,5,6,7-tetrahydro-3,6-dimethyl,p-mentha-3,8-diene, 3,9-epoxy,4,5,6,7-tetrahydro-3,6-dimethylbenzofuran,fema no. 3235,4,5,6,7-tetrahydro-3,6-dimethylcoumarone,r-menthofuran,3,6-dimethyl-4,5,6,7-tetrahydrobenzo 2,1-b furan PubChem CID: 329983 ChEBI: CHEBI:50542 IUPAC Name: 3,6-dimethyl-4,5,6,7-tetrahydro-1-benzofuran SMILES: CC1CCC2=C(C1)OC=C2C
| PubChem CID | 329983 |
|---|---|
| CAS | 494-90-6 |
| Molecular Weight (g/mol) | 150.22 |
| ChEBI | CHEBI:50542 |
| MDL Number | MFCD00041851 |
| SMILES | CC1CCC2=C(C1)OC=C2C |
| Synonym | menthofuran,menthofurane,3,9-epoxy-p-mentha-3,8-diene,benzofuran, 4,5,6,7-tetrahydro-3,6-dimethyl,p-mentha-3,8-diene, 3,9-epoxy,4,5,6,7-tetrahydro-3,6-dimethylbenzofuran,fema no. 3235,4,5,6,7-tetrahydro-3,6-dimethylcoumarone,r-menthofuran,3,6-dimethyl-4,5,6,7-tetrahydrobenzo 2,1-b furan |
| IUPAC Name | 3,6-dimethyl-4,5,6,7-tetrahydro-1-benzofuran |
| InChI Key | YGWKXXYGDYYFJU-UHFFFAOYSA-N |
| Molecular Formula | C10H14O |
(1R)-(-)-Camphor-10-sulfonic acid, 98%
CAS: 35963-20-3 Molecular Formula: C10H16O4S Molecular Weight (g/mol): 232.29 MDL Number: MFCD00150753,MFCD00064158 InChI Key: MIOPJNTWMNEORI-MHPPCMCBSA-N Synonym: l--camphorsulfonic acid,1r,4s-7,7-dimethyl-2-oxobicyclo 2.2.1 heptan-1-yl methanesulfonic acid,1r---camphor-10-sulfonic acid,unii-y6075i4fxe,camphorsulfonic acid,-,l---camphor-10-sulfonic acid,s-camphorsulfonic acid,1r,4s-7,7-dimethyl-2-oxobicyclo 2.2.1 hept-1-yl methanesulfonic acid,--camphor-10-sulfonic acid PubChem CID: 5771688 ChEBI: CHEBI:55401 SMILES: CC1(C)C2CC[C@]1(CS(O)(=O)=O)C(=O)C2
| PubChem CID | 5771688 |
|---|---|
| CAS | 35963-20-3 |
| Molecular Weight (g/mol) | 232.29 |
| ChEBI | CHEBI:55401 |
| MDL Number | MFCD00150753,MFCD00064158 |
| SMILES | CC1(C)C2CC[C@]1(CS(O)(=O)=O)C(=O)C2 |
| Synonym | l--camphorsulfonic acid,1r,4s-7,7-dimethyl-2-oxobicyclo 2.2.1 heptan-1-yl methanesulfonic acid,1r---camphor-10-sulfonic acid,unii-y6075i4fxe,camphorsulfonic acid,-,l---camphor-10-sulfonic acid,s-camphorsulfonic acid,1r,4s-7,7-dimethyl-2-oxobicyclo 2.2.1 hept-1-yl methanesulfonic acid,--camphor-10-sulfonic acid |
| InChI Key | MIOPJNTWMNEORI-MHPPCMCBSA-N |
| Molecular Formula | C10H16O4S |
Thermo Scientific Chemicals Thymolphthalein, ACS reagent
CAS: 125-20-2 Molecular Formula: C28H30O4 Molecular Weight (g/mol): 430.53 InChI Key: LDKDGDIWEUUXSH-UHFFFAOYSA-N Synonym: thymolphthalein,thymophthalein,unii-yg5i28wsqp,yg5i28wsqp,phenolphthalein, 5',5-diisopropyl-2',2-dimethyl,3,3-bis 4-hydroxy-5-isopropyl-2-methylphenyl-2-benzofuran-1 3h-one,1 3h-isobenzofuranone, 3,3-bis 4-hydroxy-2-methyl-5-1-methylethyl phenyl,5',5-diisopropyl-2',2-dimethylphenolphthalein,3,3-bis 4-hydroxy-2-methyl-5-propan-2-ylphenyl-2-benzofuran-1-one PubChem CID: 31316 IUPAC Name: 3,3-bis(4-hydroxy-2-methyl-5-propan-2-ylphenyl)-2-benzofuran-1-one SMILES: CC1=CC(=C(C=C1C2(C3=CC=CC=C3C(=O)O2)C4=CC(=C(C=C4C)O)C(C)C)C(C)C)O
| PubChem CID | 31316 |
|---|---|
| CAS | 125-20-2 |
| Molecular Weight (g/mol) | 430.53 |
| SMILES | CC1=CC(=C(C=C1C2(C3=CC=CC=C3C(=O)O2)C4=CC(=C(C=C4C)O)C(C)C)C(C)C)O |
| Synonym | thymolphthalein,thymophthalein,unii-yg5i28wsqp,yg5i28wsqp,phenolphthalein, 5',5-diisopropyl-2',2-dimethyl,3,3-bis 4-hydroxy-5-isopropyl-2-methylphenyl-2-benzofuran-1 3h-one,1 3h-isobenzofuranone, 3,3-bis 4-hydroxy-2-methyl-5-1-methylethyl phenyl,5',5-diisopropyl-2',2-dimethylphenolphthalein,3,3-bis 4-hydroxy-2-methyl-5-propan-2-ylphenyl-2-benzofuran-1-one |
| IUPAC Name | 3,3-bis(4-hydroxy-2-methyl-5-propan-2-ylphenyl)-2-benzofuran-1-one |
| InChI Key | LDKDGDIWEUUXSH-UHFFFAOYSA-N |
| Molecular Formula | C28H30O4 |
Camphene, 75%, remainder mainly alpha-fenchene
CAS: 79-92-5 Molecular Formula: C10H16 Molecular Weight (g/mol): 136.24 MDL Number: MFCD00066603 InChI Key: CRPUJAZIXJMDBK-UHFFFAOYSA-N Synonym: camphene,comphene,2,2-dimethyl-3-methylenenorbornane,3,3-dimethyl-2-methylenenorbornane,3,3-dimethyl-2-methylenenorcamphane,+/--camphene,2,2-dimethyl-3-methylenebicyclo 2.2.1 heptane,2,2-dimethyl-3-methylidenebicyclo 2.2.1 heptane,bicyclo 2.2.1 heptane, 2,2-dimethyl-3-methylene,fema no. 2229 PubChem CID: 6616 ChEBI: CHEBI:3830 IUPAC Name: 3,3-dimethyl-2-methylidenebicyclo[2.2.1]heptane SMILES: CC1(C2CCC(C2)C1=C)C
| PubChem CID | 6616 |
|---|---|
| CAS | 79-92-5 |
| Molecular Weight (g/mol) | 136.24 |
| ChEBI | CHEBI:3830 |
| MDL Number | MFCD00066603 |
| SMILES | CC1(C2CCC(C2)C1=C)C |
| Synonym | camphene,comphene,2,2-dimethyl-3-methylenenorbornane,3,3-dimethyl-2-methylenenorbornane,3,3-dimethyl-2-methylenenorcamphane,+/--camphene,2,2-dimethyl-3-methylenebicyclo 2.2.1 heptane,2,2-dimethyl-3-methylidenebicyclo 2.2.1 heptane,bicyclo 2.2.1 heptane, 2,2-dimethyl-3-methylene,fema no. 2229 |
| IUPAC Name | 3,3-dimethyl-2-methylidenebicyclo[2.2.1]heptane |
| InChI Key | CRPUJAZIXJMDBK-UHFFFAOYSA-N |
| Molecular Formula | C10H16 |
(S)-cis-Verbenol, 97%, sum of isomers
CAS: 18881-04-4 Molecular Formula: C10H16O Molecular Weight (g/mol): 152.24 MDL Number: MFCD00065444 InChI Key: WONIGEXYPVIKFS-YIZRAAEISA-N Synonym: s-cis-verbenol,verbenol, s-cis,unii-xr9t57f48t,cis-verbenol,bicyclo 3.1.1 hept-3-en-2-ol, 4,6,6-trimethyl-, 1s,2s,5s,1s-cis-verbenol,ccris 5289,?-cis-verbenol PubChem CID: 87839 IUPAC Name: (1S,2S,5S)-4,6,6-trimethylbicyclo[3.1.1]hept-3-en-2-ol SMILES: CC1=CC(C2CC1C2(C)C)O
| PubChem CID | 87839 |
|---|---|
| CAS | 18881-04-4 |
| Molecular Weight (g/mol) | 152.24 |
| MDL Number | MFCD00065444 |
| SMILES | CC1=CC(C2CC1C2(C)C)O |
| Synonym | s-cis-verbenol,verbenol, s-cis,unii-xr9t57f48t,cis-verbenol,bicyclo 3.1.1 hept-3-en-2-ol, 4,6,6-trimethyl-, 1s,2s,5s,1s-cis-verbenol,ccris 5289,?-cis-verbenol |
| IUPAC Name | (1S,2S,5S)-4,6,6-trimethylbicyclo[3.1.1]hept-3-en-2-ol |
| InChI Key | WONIGEXYPVIKFS-YIZRAAEISA-N |
| Molecular Formula | C10H16O |
Bis(pentamethylcyclopentadienyl)titanium dichloride, Thermo Scientific Chemicals
CAS: 11136-36-0 Molecular Formula: C20H30Cl2Ti Molecular Weight (g/mol): 389.227 MDL Number: MFCD00049153 InChI Key: ZBFBXTFQCKIUHU-UHFFFAOYSA-L Synonym: titanium 4+ chloride 2,3,4,5,5-pentamethylcyclopenta-1,3-dien-1-ide 1/2/2 PubChem CID: 91997586 IUPAC Name: 1,2,3,5,5-pentamethylcyclopenta-1,3-diene;titanium(4+);dichloride SMILES: CC1=[C-]C(C(=C1C)C)(C)C.CC1=[C-]C(C(=C1C)C)(C)C.[Cl-].[Cl-].[Ti+4]
| PubChem CID | 91997586 |
|---|---|
| CAS | 11136-36-0 |
| Molecular Weight (g/mol) | 389.227 |
| MDL Number | MFCD00049153 |
| SMILES | CC1=[C-]C(C(=C1C)C)(C)C.CC1=[C-]C(C(=C1C)C)(C)C.[Cl-].[Cl-].[Ti+4] |
| Synonym | titanium 4+ chloride 2,3,4,5,5-pentamethylcyclopenta-1,3-dien-1-ide 1/2/2 |
| IUPAC Name | 1,2,3,5,5-pentamethylcyclopenta-1,3-diene;titanium(4+);dichloride |
| InChI Key | ZBFBXTFQCKIUHU-UHFFFAOYSA-L |
| Molecular Formula | C20H30Cl2Ti |
Paclitaxel, 99.5+%
CAS: 33069-62-4 Molecular Formula: C47H51NO14 Molecular Weight (g/mol): 853.92 MDL Number: MFCD00869953 InChI Key: RCINICONZNJXQF-VAZQATRQSA-N Synonym: paclitaxel,taxol,taxol a,abraxane,paxene,paxceed,plaxicel,yewtaxan,onxol,ebetaxel PubChem CID: 133640187 IUPAC Name: (1S,2S,4S,7R,9S,10S,12R,15S)-4,12-bis(acetyloxy)-1,9-dihydroxy-15-{[(2R,3S)-2-hydroxy-3-phenyl-3-(phenylformamido)propanoyl]oxy}-10,14,17,17-tetramethyl-11-oxo-6-oxatetracyclo[11.3.1.0³,¹⁰.0⁴,⁷]heptadec-13-en-2-yl benzoate SMILES: CC(=O)O[C@@H]1C2=C(C)[C@H](C[C@@](O)([C@@H](OC(=O)C3=CC=CC=C3)C3[C@@]4(CO[C@@H]4C[C@H](O)[C@@]3(C)C1=O)OC(C)=O)C2(C)C)OC(=O)[C@H](O)[C@@H](NC(=O)C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 133640187 |
|---|---|
| CAS | 33069-62-4 |
| Molecular Weight (g/mol) | 853.92 |
| MDL Number | MFCD00869953 |
| SMILES | CC(=O)O[C@@H]1C2=C(C)[C@H](C[C@@](O)([C@@H](OC(=O)C3=CC=CC=C3)C3[C@@]4(CO[C@@H]4C[C@H](O)[C@@]3(C)C1=O)OC(C)=O)C2(C)C)OC(=O)[C@H](O)[C@@H](NC(=O)C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | paclitaxel,taxol,taxol a,abraxane,paxene,paxceed,plaxicel,yewtaxan,onxol,ebetaxel |
| IUPAC Name | (1S,2S,4S,7R,9S,10S,12R,15S)-4,12-bis(acetyloxy)-1,9-dihydroxy-15-{[(2R,3S)-2-hydroxy-3-phenyl-3-(phenylformamido)propanoyl]oxy}-10,14,17,17-tetramethyl-11-oxo-6-oxatetracyclo[11.3.1.0³,¹⁰.0⁴,⁷]heptadec-13-en-2-yl benzoate |
| InChI Key | RCINICONZNJXQF-VAZQATRQSA-N |
| Molecular Formula | C47H51NO14 |
Thermo Scientific Chemicals Paclitaxel, 99+%
CAS: 33069-62-4 Molecular Formula: C47H51NO14 Molecular Weight (g/mol): 853.92 MDL Number: MFCD00869953 InChI Key: RCINICONZNJXQF-VAZQATRQSA-N Synonym: paclitaxel,taxol,taxol a,abraxane,paxene,paxceed,plaxicel,yewtaxan,onxol,ebetaxel PubChem CID: 133640187 IUPAC Name: (1S,2S,4S,7R,9S,10S,12R,15S)-4,12-bis(acetyloxy)-1,9-dihydroxy-15-{[(2R,3S)-2-hydroxy-3-phenyl-3-(phenylformamido)propanoyl]oxy}-10,14,17,17-tetramethyl-11-oxo-6-oxatetracyclo[11.3.1.0³,¹⁰.0⁴,⁷]heptadec-13-en-2-yl benzoate SMILES: CC(=O)O[C@@H]1C2=C(C)[C@H](C[C@@](O)([C@@H](OC(=O)C3=CC=CC=C3)C3[C@@]4(CO[C@@H]4C[C@H](O)[C@@]3(C)C1=O)OC(C)=O)C2(C)C)OC(=O)[C@H](O)[C@@H](NC(=O)C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 133640187 |
|---|---|
| CAS | 33069-62-4 |
| Molecular Weight (g/mol) | 853.92 |
| MDL Number | MFCD00869953 |
| SMILES | CC(=O)O[C@@H]1C2=C(C)[C@H](C[C@@](O)([C@@H](OC(=O)C3=CC=CC=C3)C3[C@@]4(CO[C@@H]4C[C@H](O)[C@@]3(C)C1=O)OC(C)=O)C2(C)C)OC(=O)[C@H](O)[C@@H](NC(=O)C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | paclitaxel,taxol,taxol a,abraxane,paxene,paxceed,plaxicel,yewtaxan,onxol,ebetaxel |
| IUPAC Name | (1S,2S,4S,7R,9S,10S,12R,15S)-4,12-bis(acetyloxy)-1,9-dihydroxy-15-{[(2R,3S)-2-hydroxy-3-phenyl-3-(phenylformamido)propanoyl]oxy}-10,14,17,17-tetramethyl-11-oxo-6-oxatetracyclo[11.3.1.0³,¹⁰.0⁴,⁷]heptadec-13-en-2-yl benzoate |
| InChI Key | RCINICONZNJXQF-VAZQATRQSA-N |
| Molecular Formula | C47H51NO14 |