Diterpenoids

Aphidicolin, ACROS Organics™

CAS: 38966-21-1 Molecular Formula: C20H34O4 Molecular Weight (g/mol): 338.488 MDL Number: MFCD00083214 InChI Key: NOFOAYPPHIUXJR-APNQCZIXSA-N Synonym: +-aphidicolin PubChem CID: 457964 ChEBI: CHEBI:2766 SMILES: CC12CCC(C(C1CCC3C24CCC(C(C3)C4)(CO)O)(C)CO)O

Alfa Aesar™ Paclitaxel, 99.5+%

CAS: 33069-62-4 Molecular Formula: C47H51NO14 Molecular Weight (g/mol): 853.918 MDL Number: MFCD00869953 InChI Key: RCINICONZNJXQF-KZBGKPSISA-N Synonym: abraxane PubChem CID: 133640187 SMILES: CC1=C2C(C(=O)C3(C(CC4C(C3C(C(C2(C)C)(CC1OC(=O)C(C(C5=CC=CC=C5)NC(=O)C6=CC=CC=C6)O)O)OC(=O)C7=CC=CC=C7)(CO4)OC(=O)C)O)C)OC(=O)C

2,6,10,14-Tetramethylpentadecane, 95%, ACROS Organics™

CAS: 1921-70-6 Molecular Formula: C19H40 Molecular Weight (g/mol): 268.51 InChI Key: XOJVVFBFDXDTEG-UHFFFAOYSA-N Synonym: 2,6,10,10-tetramethylpentadecane PubChem CID: 15979 ChEBI: CHEBI:53181 IUPAC Name: 2,6,10,14-tetramethylpentadecane SMILES: CC(C)CCCC(C)CCCC(C)CCCC(C)C

Paclitaxel, 99+%, ACROS Organics™

CAS: 33069-62-4 Molecular Formula: C47H51NO14 Molecular Weight (g/mol): 853.918 MDL Number: MFCD00869953 InChI Key: RCINICONZNJXQF-KZBGKPSISA-N Synonym: abraxane PubChem CID: 133640187 SMILES: CC1=C2C(C(=O)C3(C(CC4C(C3C(C(C2(C)C)(CC1OC(=O)C(C(C5=CC=CC=C5)NC(=O)C6=CC=CC=C6)O)O)OC(=O)C7=CC=CC=C7)(CO4)OC(=O)C)O)C)OC(=O)C

Alfa Aesar™ Farnesylacetone, mixture of isomers, 97%

CAS: 762-29-8 Molecular Formula: C18H30O Molecular Weight (g/mol): 262.437 MDL Number: MFCD00036517 InChI Key: LTUMRKDLVGQMJU-IUBLYSDUSA-N Synonym: 2,6,10-trimethyl-2,6,10-pentadecatrien-14-one PubChem CID: 1711945 ChEBI: CHEBI:67252 IUPAC Name: (5E,9E)-6,10,14-trimethylpentadeca-5,9,13-trien-2-one SMILES: CC(=CCCC(=CCCC(=CCCC(=O)C)C)C)C

Alfa Aesar™ Docetaxel, 99%

CAS: 114977-28-5 Molecular Formula: C43H53NO14 Molecular Weight (g/mol): 807.89 MDL Number: MFCD00800737 InChI Key: ZDZOTLJHXYCWBA-VCVYQWHSSA-N Synonym: docetaxel PubChem CID: 148124 ChEBI: CHEBI:4672 SMILES: CC1=C2C(C(=O)C3(C(CC4C(C3C(C(C2(C)C)(CC1OC(=O)C(C(C5=CC=CC=C5)NC(=O)OC(C)(C)C)O)O)OC(=O)C6=CC=CC=C6)(CO4)OC(=O)C)O)C)O

Aphidicolin, >99%, MP Biomedicals™

CAS: 38966-21-1 Molecular Formula: C20H34O4 Molecular Weight (g/mol): 338.488 InChI Key: NOFOAYPPHIUXJR-APNQCZIXSA-N Synonym: +-aphidicolin PubChem CID: 457964 ChEBI: CHEBI:2766 SMILES: CC12CCC(C(C1CCC3C24CCC(C(C3)C4)(CO)O)(C)CO)O

Phytol 90.0+%, TCI America™

CAS: 150-86-7 Molecular Formula: C20H40O Molecular Weight (g/mol): 296.539 MDL Number: MFCD00151280 InChI Key: BOTWFXYSPFMFNR-HMMYKYKNSA-N Synonym: 2-hexadecen-1-ol, 3,7,11,15-tetramethyl PubChem CID: 5366244 IUPAC Name: (E)-3,7,11,15-tetramethylhexadec-2-en-1-ol SMILES: CC(C)CCCC(C)CCCC(C)CCCC(=CCO)C

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: .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

2,6,10,14-Tetramethylpentadecane 95.0+%, TCI America™

CAS: 1921-70-6 Molecular Formula: C19H40 Molecular Weight (g/mol): 268.529 MDL Number: MFCD00008952 InChI Key: XOJVVFBFDXDTEG-UHFFFAOYSA-N Synonym: 2,6,10,10-tetramethylpentadecane PubChem CID: 15979 ChEBI: CHEBI:53181 IUPAC Name: 2,6,10,14-tetramethylpentadecane SMILES: CC(C)CCCC(C)CCCC(C)CCCC(C)C

Taxol, Tocris Bioscience™

CAS: 33069-62-4 Molecular Formula: C47H51NO14 Molecular Weight (g/mol): 853.918 InChI Key: RCINICONZNJXQF-KZBGKPSISA-N Synonym: abraxane PubChem CID: 133640187 SMILES: CC1=C2C(C(=O)C3(C(CC4C(C3C(C(C2(C)C)(CC1OC(=O)C(C(C5=CC=CC=C5)NC(=O)C6=CC=CC=C6)O)O)OC(=O)C7=CC=CC=C7)(CO4)OC(=O)C)O)C)OC(=O)C

5'-Iodoresiniferatoxin, Tocris Bioscience™ Available on GSA/VA Contract for Federal Government customers only.

CAS: 535974-91-5 Molecular Formula: C37H39IO9 Molecular Weight (g/mol): 754.614 InChI Key: TZUJORCXGLGWDV-RYACRXIZSA-N Synonym: 1r,2r,6r,10s,11r,15r,17r-13-benzyl-6-hydroxy-4,17-dimethyl-5-oxo-15-prop-1-en-2-yl-12,14,18-trioxapentacyclo 11.4.1.0; 1,10 .0; 2,6 .0; 11,15 octadeca-3,8-dien-8-yl methyl 2-4-hydroxy-3-iodo-5-methoxyphenyl acetate PubChem CID: 16219535 SMILES: CC1CC2(C3C4C1(C5C=C(C(=O)C5(CC(=C4)COC(=O)CC6=CC(=C(C(=C6)I)O)OC)O)C)OC(O3)(O2)CC7=CC=CC=C7)C(=C)C

Docetaxel 98.0+%, TCI America™

CAS: 114977-28-5 Molecular Formula: C43H53NO14 Molecular Weight (g/mol): 807.89 MDL Number: MFCD00800737 InChI Key: ZDZOTLJHXYCWBA-VCVYQWHSSA-N Synonym: docetaxel PubChem CID: 148124 ChEBI: CHEBI:4672 SMILES: CC1=C2C(C(=O)C3(C(CC4C(C3C(C(C2(C)C)(CC1OC(=O)C(C(C5=CC=CC=C5)NC(=O)OC(C)(C)C)O)O)OC(=O)C6=CC=CC=C6)(CO4)OC(=O)C)O)C)O

Phytol, 99+%, Ultra Scientific

CAS: 7541-49-3 Molecular Formula: C20H40O Molecular Weight (g/mol): 296.539 InChI Key: BOTWFXYSPFMFNR-HMMYKYKNSA-N Synonym: 3,7,11,15-Tetramethyl-2-hexadecen-1-ol PubChem CID: 5366244 IUPAC Name: (E)-3,7,11,15-tetramethylhexadec-2-en-1-ol SMILES: CC(C)CCCC(C)CCCC(C)CCCC(=CCO)C

Docetaxel, 98%, Acros Organics™

CAS: 114977-28-5 Molecular Formula: C43H53NO14 Molecular Weight (g/mol): 807.89 InChI Key: ZDZOTLJHXYCWBA-VCVYQWHSSA-N Synonym: docetaxel PubChem CID: 148124 ChEBI: CHEBI:4672 SMILES: CC1=C2C(C(=O)C3(C(CC4C(C3C(C(C2(C)C)(CC1OC(=O)C(C(C5=CC=CC=C5)NC(=O)OC(C)(C)C)O)O)OC(=O)C6=CC=CC=C6)(CO4)OC(=O)C)O)C)O

Alfa Aesar™ Resiniferatoxin, 99+%

CAS: 57444-62-9 Molecular Formula: C37H40O9 Molecular Weight (g/mol): 628.718 MDL Number: MFCD00135927 InChI Key: DSDNAKHZNJAGHN-BWVJFJMLSA-N Synonym: resiniferatoxin PubChem CID: 57090162 SMILES: CC1CC2(C3C4C1(C5C=C(C(=O)C5(CC(=C4)COC(=O)CC6=CC(=C(C=C6)O)OC)O)C)OC(O3)(O2)CC7=CC=CC=C7)C(=C)C

Alfa Aesar™ Isophytol, 95%

CAS: 505-32-8 Molecular Formula: C20H40O Molecular Weight (g/mol): 296.539 MDL Number: MFCD00048380 InChI Key: KEVYVLWNCKMXJX-UHFFFAOYSA-N Synonym: 1-hexadecen-3-ol, 3,7,11,15-tetramethyl PubChem CID: 10453 IUPAC Name: 3,7,11,15-tetramethylhexadec-1-en-3-ol SMILES: CC(C)CCCC(C)CCCC(C)CCCC(C)(C=C)O

Geranyl linalool, ca. 95%, Tech., mixture of isomers, ACROS Organics™

CAS: 1113-21-9 Molecular Formula: C20H34O Molecular Weight (g/mol): 290.48 InChI Key: IQDXAJNQKSIPGB-HQSZAHFGSA-N Synonym: 1,6,10,14-hexadecatetraen-3-ol, 3,7,11,15-tetramethyl PubChem CID: 5365872 ChEBI: CHEBI:74299 IUPAC Name: (6E,10E)-3,7,11,15-tetramethylhexadeca-1,6,10,14-tetraen-3-ol SMILES: CC(=CCCC(=CCCC(=CCCC(C)(C=C)O)C)C)C

Pristane, MP Biomedicals™

CAS: 1921-70-6 Molecular Formula: C19H40 Molecular Weight (g/mol): 268.529 InChI Key: XOJVVFBFDXDTEG-UHFFFAOYSA-N Synonym: 2,6,10,10-tetramethylpentadecane PubChem CID: 15979 ChEBI: CHEBI:53181 IUPAC Name: 2,6,10,14-tetramethylpentadecane SMILES: CC(C)CCCC(C)CCCC(C)CCCC(C)C

Cryptotanshinone 97.0+%, TCI America™

CAS: 35825-57-1 Molecular Formula: C19H20O3 Molecular Weight (g/mol): 296.366 MDL Number: MFCD07636810 InChI Key: GVKKJJOMQCNPGB-JTQLQIEISA-N Synonym: Tanshinone C, (R)-1,2,6,7,8,9-Hexahydro-1,6,6-trimethylphenanthro[1,2-b]furan-10,11-dione PubChem CID: 160254 IUPAC Name: (1R)-1,6,6-trimethyl-2,7,8,9-tetrahydro-1H-naphtho[1,2-g][1]benzofuran-10,11-dione SMILES: CC1COC2=C1C(=O)C(=O)C3=C2C=CC4=C3CCCC4(C)C

Phytyl Acetate (cis- and trans- mixture) 88.0+%, TCI America™

CAS: 10236-16-5 Molecular Formula: C22H42O2 Molecular Weight (g/mol): 338.576 InChI Key: JIGCTXHIECXYRJ-UHFFFAOYSA-N Synonym: Acetic Acid 3,7,11,15-Tetramethyl-2-hexadecenyl Ester, 3,7,11,15-Tetramethyl-2-hexadecenyl Acetate PubChem CID: 53425386 IUPAC Name: 3,7,11,15-tetramethylhexadec-2-enyl acetate SMILES: CC(C)CCCC(C)CCCC(C)CCCC(=CCOC(=O)C)C

Isophytol 95.0+%, TCI America™

CAS: 505-32-8 Molecular Formula: C20H40O Molecular Weight (g/mol): 296.539 MDL Number: MFCD00048380 InChI Key: KEVYVLWNCKMXJX-UHFFFAOYSA-N Synonym: 1-hexadecen-3-ol, 3,7,11,15-tetramethyl PubChem CID: 10453 IUPAC Name: 3,7,11,15-tetramethylhexadec-1-en-3-ol SMILES: CC(C)CCCC(C)CCCC(C)CCCC(C)(C=C)O

Geranyl-linalool (mixture of isomers) 90.0+%, TCI America™

CAS: 68931-30-6 Molecular Formula: C20H34O Molecular Weight (g/mol): 290.491 MDL Number: MFCD00059363 InChI Key: IQDXAJNQKSIPGB-HQSZAHFGSA-N Synonym: 3,7,11,15-Tetramethyl-1,6,10,14-hexadecatetraen-3-ol PubChem CID: 5365872 ChEBI: CHEBI:74299 IUPAC Name: (6E,10E)-3,7,11,15-tetramethylhexadeca-1,6,10,14-tetraen-3-ol SMILES: CC(=CCCC(=CCCC(=CCCC(C)(C=C)O)C)C)C

Tanshinone IIA 97.0+%, TCI America™

CAS: 568-72-9 Molecular Formula: C19H18O3 Molecular Weight (g/mol): 294.35 MDL Number: MFCD00238692 InChI Key: HYXITZLLTYIPOF-UHFFFAOYSA-N Synonym: 1,6,6-trimethyl-6,7,8,9-tetrahydrophenanthro 1,2-b furan-10,11-dione PubChem CID: 164676 IUPAC Name: 1,6,6-trimethyl-8,9-dihydro-7H-naphtho[1,2-g][1]benzofuran-10,11-dione SMILES: CC1=COC2=C1C(=O)C(=O)C3=C2C=CC4=C3CCCC4(C)C

Paclitaxel 98.0+%, TCI America™

CAS: 33069-62-4 Molecular Formula: C47H51NO14 Molecular Weight (g/mol): 853.918 InChI Key: RCINICONZNJXQF-KZBGKPSISA-N Synonym: abraxane PubChem CID: 133640187 SMILES: CC1=C2C(C(=O)C3(C(CC4C(C3C(C(C2(C)C)(CC1OC(=O)C(C(C5=CC=CC=C5)NC(=O)C6=CC=CC=C6)O)O)OC(=O)C7=CC=CC=C7)(CO4)OC(=O)C)O)C)OC(=O)C

Phytantriol (mixture of isomers) 95.0+%, TCI America™

CAS: 74563-64-7 Molecular Formula: C20H42O3 Molecular Weight (g/mol): 330.553 InChI Key: CGIHFIDULQUVJG-UHFFFAOYSA-N Synonym: 3,7,11,15-Tetramethylhexadecane-1,2,3-triol, 1,2,3-Trihydroxy-3,7,11,15-tetramethylhexadecane PubChem CID: 3018525 ChEBI: CHEBI:47770 IUPAC Name: 3,7,11,15-tetramethylhexadecane-1,2,3-triol SMILES: CC(C)CCCC(C)CCCC(C)CCCC(C)(C(CO)O)O

2,6,10,14-Tetramethylpentadecane, SPEX CertiPrep™

CAS: 1921-70-6 Molecular Formula: C19H40 Molecular Weight (g/mol): 268.529 InChI Key: XOJVVFBFDXDTEG-UHFFFAOYSA-N PubChem CID: 15979 ChEBI: CHEBI:53181 IUPAC Name: 2,6,10,14-tetramethylpentadecane SMILES: CC(C)CCCC(C)CCCC(C)CCCC(C)C

Teprenone 95.0+%, TCI America™

CAS: 6809-52-5 Molecular Formula: C23H38O Molecular Weight (g/mol): 330.556 MDL Number: MFCD00869547 InChI Key: HUCXKZBETONXFO-AJDZVAQLSA-N Synonym: Geranylgeranylacetone, 6,10,14,18-Tetramethyl-5,9,13,17-nonadecatetraen-2-one PubChem CID: 53384398 ChEBI: CHEBI:31649 IUPAC Name: (9E,13E)-6,10,14,18-tetramethylnonadeca-5,9,13,17-tetraen-2-one SMILES: CC(=CCCC(=CCCC(=CCCC(=CCCC(=O)C)C)C)C)C

Phytane, SPEX CertiPrep™

CAS: 638-36-8 Molecular Formula: C20H42 Molecular Weight (g/mol): 282.556 InChI Key: GGYKPYDKXLHNTI-UHFFFAOYSA-N PubChem CID: 12523 ChEBI: CHEBI:48937 IUPAC Name: 2,6,10,14-tetramethylhexadecane SMILES: CCC(C)CCCC(C)CCCC(C)CCCC(C)C

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