Unclassified Organic Compounds

Organic compounds that do not fit into any other organic chemical classification.

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1,216 – 1,230 of 202,914 results

1,216

Cellulose acetate phthalate , MilliporeSigma™ Supelco™

MDL Number: MFCD00072769

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MDL Number	MFCD00072769

1,217

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Thermo Scientific Chemicals Coenzyme B12

CAS: 13870-90-1 Molecular Formula: C72H100CoN18O17P Molecular Weight (g/mol): 1579.61 InChI Key: OAJLVMGLJZXSGX-UHFFFAOYNA-L IUPAC Name: cobalt(3+) 4,9,14-tris(2-carbamoylethyl)-3,8,19-tris(carbamoylmethyl)-18-{2-[(2-{[5-(5,6-dimethyl-1H-1,3-benzodiazol-1-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl phosphonato]oxy}propyl)carbamoyl]ethyl}-2,3,6,8,13,13,16,18-octamethyl-20,21,22,23-tetraazapentacyclo[15.2.1.1²,⁵.1⁷,¹⁰.1¹²,¹⁵]tricosa-5(23),6,10(22),11,15(21),16-hexaen-20-ide [5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methanide SMILES: [Co+3].[CH2-]C1OC(C(O)C1O)N1C=NC2=C(N)N=CN=C12.CC(CNC(=O)CCC1(C)C(CC(N)=O)C2[N-]C1=C(C)C1=NC(=CC3=NC(=C(C)C4=NC2(C)C(C)(CC(N)=O)C4CCC(N)=O)C(C)(CC(N)=O)C3CCC(N)=O)C(C)(C)C1CCC(N)=O)OP([O-])(=O)OC1C(CO)OC(C1O)N1C=NC2=CC(C)=C(C)C=C12

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Specifications

CAS	13870-90-1
Molecular Weight (g/mol)	1579.61
SMILES	[Co+3].[CH2-]C1OC(C(O)C1O)N1C=NC2=C(N)N=CN=C12.CC(CNC(=O)CCC1(C)C(CC(N)=O)C2[N-]C1=C(C)C1=NC(=CC3=NC(=C(C)C4=NC2(C)C(C)(CC(N)=O)C4CCC(N)=O)C(C)(CC(N)=O)C3CCC(N)=O)C(C)(C)C1CCC(N)=O)OP([O-])(=O)OC1C(CO)OC(C1O)N1C=NC2=CC(C)=C(C)C=C12
IUPAC Name	cobalt(3+) 4,9,14-tris(2-carbamoylethyl)-3,8,19-tris(carbamoylmethyl)-18-{2-[(2-{[5-(5,6-dimethyl-1H-1,3-benzodiazol-1-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl phosphonato]oxy}propyl)carbamoyl]ethyl}-2,3,6,8,13,13,16,18-octamethyl-20,21,22,23-tetraazapentacyclo[15.2.1.1²,⁵.1⁷,¹⁰.1¹²,¹⁵]tricosa-5(23),6,10(22),11,15(21),16-hexaen-20-ide [5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methanide
InChI Key	OAJLVMGLJZXSGX-UHFFFAOYNA-L
Molecular Formula	C72H100CoN18O17P

1,218

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Thermo Scientific Chemicals Pravastatin sodium salt hydrate

CAS: 2244386-63-6 Molecular Formula: C23H35NaO7 Molecular Weight (g/mol): 446.52 MDL Number: MFCD00887601 InChI Key: VWBQYTRBTXKKOG-IYNICTALSA-M IUPAC Name: sodium (3R,5R)-7-[(1S,2S,6S,8S,8aR)-6-hydroxy-2-methyl-8-{[(2S)-2-methylbutanoyl]oxy}-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]-3,5-dihydroxyheptanoate SMILES: [Na+].[H][C@]12[C@H](C[C@H](O)C=C1C=C[C@H](C)[C@@H]2CC[C@@H](O)C[C@@H](O)CC([O-])=O)OC(=O)[C@@H](C)CC

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CAS	2244386-63-6
Molecular Weight (g/mol)	446.52
MDL Number	MFCD00887601
SMILES	[Na+].[H][C@]12[C@H](C[C@H](O)C=C1C=C[C@H](C)[C@@H]2CC[C@@H](O)C[C@@H](O)CC([O-])=O)OC(=O)[C@@H](C)CC
IUPAC Name	sodium (3R,5R)-7-[(1S,2S,6S,8S,8aR)-6-hydroxy-2-methyl-8-{[(2S)-2-methylbutanoyl]oxy}-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]-3,5-dihydroxyheptanoate
InChI Key	VWBQYTRBTXKKOG-IYNICTALSA-M
Molecular Formula	C23H35NaO7

1,219

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Ritonavir, 98%, Thermo Scientific Chemicals

CAS: 155213-67-5 Molecular Formula: C₃₇H₄₈N₆O₅S₂ Molecular Weight (g/mol): 720.94 InChI Key: NCDNCNXCDXHOMX-XGKFQTDJSA-N Synonym: ritonavir,norvir,abbott 84538,abbott-84538,ritonavir usan,norvir softgel,norvir sec,unii-o3j8g9o825,norvir tm,norvir tn PubChem CID: 392622 ChEBI: CHEBI:45409 IUPAC Name: 1,3-thiazol-5-ylmethyl N-[(2S,3S,5S)-3-hydroxy-5-[[(2S)-3-methyl-2-[[methyl-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]carbamoyl]amino]butanoyl]amino]-1,6-diphenylhexan-2-yl]carbamate SMILES: CC(C)C1=NC(=CS1)CN(C)C(=O)NC(C(C)C)C(=O)NC(CC2=CC=CC=C2)CC(C(CC3=CC=CC=C3)NC(=O)OCC4=CN=CS4)O

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PubChem CID	392622
CAS	155213-67-5
Molecular Weight (g/mol)	720.94
ChEBI	CHEBI:45409
SMILES	CC(C)C1=NC(=CS1)CN(C)C(=O)NC(C(C)C)C(=O)NC(CC2=CC=CC=C2)CC(C(CC3=CC=CC=C3)NC(=O)OCC4=CN=CS4)O
Synonym	ritonavir,norvir,abbott 84538,abbott-84538,ritonavir usan,norvir softgel,norvir sec,unii-o3j8g9o825,norvir tm,norvir tn
IUPAC Name	1,3-thiazol-5-ylmethyl N-[(2S,3S,5S)-3-hydroxy-5-[[(2S)-3-methyl-2-[[methyl-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]carbamoyl]amino]butanoyl]amino]-1,6-diphenylhexan-2-yl]carbamate
InChI Key	NCDNCNXCDXHOMX-XGKFQTDJSA-N
Molecular Formula	C₃₇H₄₈N₆O₅S₂

1,220

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Thermo Scientific Chemicals Dexmedetomidine hydrochloride

CAS: 145108-58-3 Molecular Formula: C13H17ClN2 Molecular Weight (g/mol): 236.74 InChI Key: VPNGEIHDPSLNMU-MERQFXBCSA-N IUPAC Name: hydrogen 5-[(1S)-1-(2,3-dimethylphenyl)ethyl]-1H-imidazole chloride SMILES: [H+].[Cl-].C[C@H](C1=CN=CN1)C1=CC=CC(C)=C1C

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CAS	145108-58-3
Molecular Weight (g/mol)	236.74
SMILES	[H+].[Cl-].C[C@H](C1=CN=CN1)C1=CC=CC(C)=C1C
IUPAC Name	hydrogen 5-[(1S)-1-(2,3-dimethylphenyl)ethyl]-1H-imidazole chloride
InChI Key	VPNGEIHDPSLNMU-MERQFXBCSA-N
Molecular Formula	C13H17ClN2

1,221

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Bicyclo[3.3.0]octane, Thermo Scientific™

CAS: 694-72-4 Molecular Formula: C8H14 Molecular Weight (g/mol): 110.20 MDL Number: 00060882 InChI Key: AEBWATHAIVJLTA-UHFFFAOYSA-N IUPAC Name: octahydropentalene SMILES: C1CC2CCCC2C1

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CAS	694-72-4
Molecular Weight (g/mol)	110.20
MDL Number	00060882
SMILES	C1CC2CCCC2C1
IUPAC Name	octahydropentalene
InChI Key	AEBWATHAIVJLTA-UHFFFAOYSA-N
Molecular Formula	C8H14

1,222

Bentonite, acid-leached, Thermo Scientific™

CAS: 70131-50-9

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Specifications

CAS	70131-50-9

1,223

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Moxalactam sodium salt

CAS: 64953-12-4 Molecular Formula: C20H18N6Na2O9S Molecular Weight (g/mol): 564.44 InChI Key: GRIXGZQULWMCLU-UHFFFAOYNA-L IUPAC Name: disodium 7-[2-carboxylato-2-(4-hydroxyphenyl)acetamido]-7-methoxy-3-{[(1-methyl-1H-1,2,3,4-tetrazol-5-yl)sulfanyl]methyl}-8-oxo-5-oxa-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate SMILES: [Na+].[Na+].COC1(NC(=O)C(C([O-])=O)C2=CC=C(O)C=C2)C2OCC(CSC3=NN=NN3C)=C(N2C1=O)C([O-])=O

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Specifications

CAS	64953-12-4
Molecular Weight (g/mol)	564.44
SMILES	[Na+].[Na+].COC1(NC(=O)C(C([O-])=O)C2=CC=C(O)C=C2)C2OCC(CSC3=NN=NN3C)=C(N2C1=O)C([O-])=O
IUPAC Name	disodium 7-[2-carboxylato-2-(4-hydroxyphenyl)acetamido]-7-methoxy-3-{[(1-methyl-1H-1,2,3,4-tetrazol-5-yl)sulfanyl]methyl}-8-oxo-5-oxa-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
InChI Key	GRIXGZQULWMCLU-UHFFFAOYNA-L
Molecular Formula	C20H18N6Na2O9S

1,224

Glutathione Oxidized, MP Biomedicals™

CAS: 27025-41-8 Molecular Formula: C20H32N6O12S2 Molecular Weight (g/mol): 612.63 MDL Number: MFCD00150701 InChI Key: YPZRWBKMTBYPTK-IOKZUGQQNA-N Synonym: oxiglutatione,glutathione disulfide,gssg,oxidized glutathione,glutathione disulphide,glutathione-ssg,l-glutathione oxidized,oxigluthione,glutathone disulfide,glutathione oxidized PubChem CID: 65359 ChEBI: CHEBI:17858 IUPAC Name: (2S)-2-amino-4-{[(1R)-2-{[(2R)-2-[(4S)-4-amino-4-carboxybutanamido]-2-[(carboxymethyl)carbamoyl]ethyl]disulfanyl}-1-[(carboxymethyl)carbamoyl]ethyl]carbamoyl}butanoic acid SMILES: N[C@@H](CCC(=O)N[C@@H](CSSC[C@H](NC(=O)CC[C@H](N)C(O)=O)C(=O)NCC(O)=O)C(=O)NCC(O)=O)C(O)=O

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Specifications

PubChem CID	65359
CAS	27025-41-8
Molecular Weight (g/mol)	612.63
ChEBI	CHEBI:17858
MDL Number	MFCD00150701
SMILES	N[C@@H](CCC(=O)N[C@@H](CSSC[C@H](NC(=O)CC[C@H](N)C(O)=O)C(=O)NCC(O)=O)C(=O)NCC(O)=O)C(O)=O
Synonym	oxiglutatione,glutathione disulfide,gssg,oxidized glutathione,glutathione disulphide,glutathione-ssg,l-glutathione oxidized,oxigluthione,glutathone disulfide,glutathione oxidized
IUPAC Name	(2S)-2-amino-4-{[(1R)-2-{[(2R)-2-[(4S)-4-amino-4-carboxybutanamido]-2-[(carboxymethyl)carbamoyl]ethyl]disulfanyl}-1-[(carboxymethyl)carbamoyl]ethyl]carbamoyl}butanoic acid
InChI Key	YPZRWBKMTBYPTK-IOKZUGQQNA-N
Molecular Formula	C20H32N6O12S2

1,225

Water for HPCE, For Luminescence and UV-Spectroscopy, MilliporeSigma™ Supelco™

MDL Number: MFCD00011332

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MDL Number	MFCD00011332

1,226

Conduritol B Epoxide, 98%, MP Biomedicals™

CAS: 6090-95-5 Molecular Formula: C6H10O5 Molecular Weight (g/mol): 162.141 InChI Key: ZHMWOVGZCINIHW-SCCKRLBHSA-N Synonym: 1r,2r,3s,4r,5r,6s-7-oxabicyclo 4.1.0 heptane-2,3,4,5-tetrol PubChem CID: 25797774 IUPAC Name: (1R,2R,3S,4R,5R,6S)-7-oxabicyclo[4.1.0]heptane-2,3,4,5-tetrol SMILES: C1(C(C(C2C(C1O)O2)O)O)O

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PubChem CID	25797774
CAS	6090-95-5
Molecular Weight (g/mol)	162.141
SMILES	C1(C(C(C2C(C1O)O2)O)O)O
Synonym	1r,2r,3s,4r,5r,6s-7-oxabicyclo 4.1.0 heptane-2,3,4,5-tetrol
IUPAC Name	(1R,2R,3S,4R,5R,6S)-7-oxabicyclo[4.1.0]heptane-2,3,4,5-tetrol
InChI Key	ZHMWOVGZCINIHW-SCCKRLBHSA-N
Molecular Formula	C6H10O5

1,227

Corn Oil, MP Biomedicals

CAS: 8001-30-7

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CAS	8001-30-7

1,228

Phenol chloroform isoamyl alcohol mixture, BioUltra, For molecular biology, 125:24:1, MilliporeSigma™ Supelco™

MDL Number: MFCD00133763

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MDL Number	MFCD00133763

1,229

2-(5-Bromo-2-pyridylazo)-5-[N-propyl-N-(3-sulfopropyl)amino]phenol disodium salt dihydrate, ≥95.0%, MilliporeSigma™

MDL Number: MFCD03791119 Synonym: 5-Bromo-PAPS

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Specifications

MDL Number	MFCD03791119
Synonym	5-Bromo-PAPS

1,230

Ibuprofen , ≥98% (HPLC), MilliporeSigma™ Supelco™

MDL Number: MFCD00010393 Synonym: alpha-Methyl-4-(isobutyl)phenylacetic acid; (+/-)-2-(4-Isobutylphenyl)propanoic acid

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MDL Number	MFCD00010393
Synonym	alpha-Methyl-4-(isobutyl)phenylacetic acid; (+/-)-2-(4-Isobutylphenyl)propanoic acid

Unclassified Organic Compounds

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