Sunday, October 30, 2011

http://ChemLookup.com Compounds




CAS RN: 38715-39-8
CAS Name: (Z)-2-butenedioic acid bis[[4-hydroxy-3,5,5-tris(1-oxooctadecoxymethyl)-3-oxanyl]methyl] ester
OPENEYE Name: bis[[4-hydroxy-3,5,5-tris(octadecanoyloxymethyl)tetrahydropyran-3-yl]methyl] (Z)-but-2-enedioate
IUPAC Name: bis[[4-hydroxy-3,5,5-tris(octadecanoyloxymethyl)oxan-3-yl]methyl] (Z)-but-2-enedioate
SYSTEMATIC NAME: bis[[3,5,5-tris(octadecanoyloxymethyl)-4-oxidanyl-oxan-3-yl]methyl] (Z)-but-2-enedioate
MOLECULAR FORMULA: C130H240O20
MOLECULAR WEIGHT: 2123.2846
SMILES: CCCCCCCCCCCCCCCCCC(=O)OCC1(COCC(C1O)(COC(=O)CCCCCCCCCCCCCCCCC)COC(=O)/C=C\C(=O)OCC2(COCC(C2O)(COC(=O)CCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCCCC
Structure:

CAS RN: 36531-78-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C29H38N2O4
MOLECULAR WEIGHT: 478.62302
SMILES: CCC1C(CC2C1C=CC3C2CC\4C3C/C=C/C(=O)NCCCC5C(=O)C(=C(N5)O)C(=O)/C=C4)C
Structure:

CAS RN: 36168-22-6
CAS Name: 3-[(Z)-1-oxodocos-13-enoxy]-4-(trimethylammonio)butanoate
OPENEYE Name: 3-[(Z)-docos-13-enoyl]oxy-4-(trimethylammonio)butanoate
IUPAC Name: 3-[(Z)-docos-13-enoyl]oxy-4-(trimethylazaniumyl)butanoate
SYSTEMATIC NAME: 3-[(Z)-docos-13-enoyl]oxy-4-(trimethylazaniumyl)butanoate
MOLECULAR FORMULA: C29H55NO4
MOLECULAR WEIGHT: 481.7513
SMILES: CCCCCCCC/C=C\CCCCCCCCCCCC(=O)OC(CC(=O)[O-])C[N+](C)(C)C
Structure:

CAS RN: 36084-18-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C29H37NO5
MOLECULAR WEIGHT: 479.60778
SMILES: CC1CCCC(/C=C/C(=O)OC23C(/C=C/C1)C4C(O4)(C(C2C(NC3=O)CC5=CC=CC=C5)C)C)O
Structure:

CAS RN: 35867-32-4
CAS Name: propanoic acid [(4R,5S,6S,7R,9R,10R,11E,13E,16R)-6-[[(2S,3R,4R,5S,6R)-5-[[(2S,4R,5S,6S)-5-acetyloxy-4-hydroxy-4,6-dimethyl-2-oxanyl]oxy]-4-(dimethylamino)-3-hydroxy-6-methyl-2-oxanyl]oxy]-10-hydroxy-5-methoxy-9,16-dimethyl-2-oxo-7-(2-oxoethyl)-1-oxacycloh
OPENEYE Name: [(4R,5S,6S,7R,9R,10R,11E,13E,16R)-6-[(2S,3R,4R,5S,6R)-5-[(2S,4R,5S,6S)-5-acetoxy-4-hydroxy-4,6-dimethyl-tetrahydropyran-2-yl]oxy-4-(dimethylamino)-3-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-10-hydroxy-5-methoxy-9,16-dimethyl-2-oxo-7-(2-oxoethyl)-1-oxacyc
IUPAC Name: [(4R,5S,6S,7R,9R,10R,11E,13E,16R)-6-[(2S,3R,4R,5S,6R)-5-[(2S,4R,5S,6S)-5-acetyloxy-4-hydroxy-4,6-dimethyloxan-2-yl]oxy-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-10-hydroxy-5-methoxy-9,16-dimethyl-2-oxo-7-(2-oxoethyl)-1-oxacyclohexadeca-11,13-dien-
SYSTEMATIC NAME: [(4R,5S,6S,7R,9R,10R,11E,13E,16R)-6-[(2S,3R,4R,5S,6R)-5-[(2S,4R,5S,6S)-5-acetyloxy-4,6-dimethyl-4-oxidanyl-oxan-2-yl]oxy-4-(dimethylamino)-6-methyl-3-oxidanyl-oxan-2-yl]oxy-5-methoxy-9,16-dimethyl-10-oxidanyl-2-oxidanylidene-7-(2-oxidanylideneethyl)-1-oxa
MOLECULAR FORMULA: C40H65NO15
MOLECULAR WEIGHT: 799.9418
SMILES: CCC(=O)O[C@@H]1CC(=O)O[C@@H](C/C=C/C=C/[C@@H]([C@@H](C[C@@H]([C@@H]([C@H]1OC)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C)O[C@H]3C[C@@]([C@H]([C@@H](O3)C)OC(=O)C)(C)O)N(C)C)O)CC=O)C)O)C
Structure:

CAS RN: 35842-45-6
CAS Name: 2-[[(E)-2-methyl-1-oxobut-2-enyl]amino]acetic acid
OPENEYE Name: 2-[[(E)-2-methylbut-2-enoyl]amino]acetic acid
IUPAC Name: 2-[[(E)-2-methylbut-2-enoyl]amino]acetic acid
SYSTEMATIC NAME: 2-[[(E)-2-methylbut-2-enoyl]amino]ethanoic acid
MOLECULAR FORMULA: C7H11NO3
MOLECULAR WEIGHT: 157.16714
SMILES: C/C=C(\C)/C(=O)NCC(=O)O
Structure:

CAS RN: 35827-02-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C51H66N4O12
MOLECULAR WEIGHT: 927.08934
SMILES: C[C@H]1/C=C/C=C(/C(=O)NC\2=C(C3=C(C(=C4C(=C3C(=O)/C2=C/NN5CC(N(CC5C)CC6=CC=CC=C6)C)C(=O)[C@](O4)(O/C=C/[C@@H]([C@H]([C@H]([C@@H]([C@@H]([C@@H]([C@H]1O)C)O)C)OC(=O)C)C)OC)C)C)O)O)\C
Structure:

CAS RN: 35823-61-1
CAS Name: N-[(E,3R)-3-hydroxy-1-[[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]octadec-4-en-2-yl]acetamide
OPENEYE Name: N-[(E,2R)-2-hydroxy-1-[[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxymethyl]heptadec-3-enyl]acetamide
IUPAC Name: N-[(E,3R)-3-hydroxy-1-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoctadec-4-en-2-yl]acetamide
SYSTEMATIC NAME: N-[(E,3R)-1-[(2S,3R,4S,5R,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-3-oxidanyl-octadec-4-en-2-yl]ethanamide
MOLECULAR FORMULA: C26H49NO8
MOLECULAR WEIGHT: 503.66916
SMILES: CCCCCCCCCCCCC/C=C/[C@H](C(CO[C@@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O)NC(=O)C)O
Structure:

CAS RN: 35075-74-2
CAS Name: (E,6R,8S)-1,11-bis(3-furanyl)-4,8-dimethyl-3-undecen-6-ol
OPENEYE Name: (E,6R,8S)-1,11-bis(3-furyl)-4,8-dimethyl-undec-3-en-6-ol
IUPAC Name: (E,6R,8S)-1,11-bis(furan-3-yl)-4,8-dimethylundec-3-en-6-ol
SYSTEMATIC NAME: (E,6R,8S)-1,11-bis(furan-3-yl)-4,8-dimethyl-undec-3-en-6-ol
MOLECULAR FORMULA: C21H30O3
MOLECULAR WEIGHT: 330.4611
SMILES: C[C@@H](CCCC1=COC=C1)C[C@H](C/C(=C/CCC2=COC=C2)/C)O
Structure:

CAS RN: 34828-50-7
CAS Name: ammonium; furan-2,5-dione; (Z)-4-methoxy-4-oxo-2-butenoate; styrene
OPENEYE Name: ammonium; furan-2,5-dione; (Z)-4-methoxy-4-oxo-but-2-enoate; styrene
IUPAC Name: azanium; furan-2,5-dione; (Z)-4-methoxy-4-oxobut-2-enoate; styrene
SYSTEMATIC NAME: azanium; ethenylbenzene; furan-2,5-dione; (Z)-4-methoxy-4-oxidanylidene-but-2-enoate
MOLECULAR FORMULA: C17H19NO7
MOLECULAR WEIGHT: 349.33526
SMILES: COC(=O)/C=C\C(=O)[O-].C=CC1=CC=CC=C1.C1=CC(=O)OC1=O.[NH4+]
Structure:

CAS RN: 34487-26-8
CAS Name: octadecanoic acid [(2S)-3-hydroxy-2-[(9Z,12Z)-1-oxooctadeca-9,12-dienoxy]propyl] ester
OPENEYE Name: [(2S)-3-hydroxy-2-[(9Z,12Z)-octadeca-9,12-dienoyl]oxy-propyl] octadecanoate
IUPAC Name: [(2S)-3-hydroxy-2-[(9Z,12Z)-octadeca-9,12-dienoyl]oxypropyl] octadecanoate
SYSTEMATIC NAME: [(2S)-2-[(9Z,12Z)-octadeca-9,12-dienoyl]oxy-3-oxidanyl-propyl] octadecanoate
MOLECULAR FORMULA: C39H72O5
MOLECULAR WEIGHT: 620.98598
SMILES: CCCCCCCCCCCCCCCCCC(=O)OC[C@H](CO)OC(=O)CCCCCCC/C=C\C/C=C\CCCCC
Structure:

CAS RN: 34347-28-9
CAS Name: (3S,8S,9S,10R,13R,14S)-10,13-dimethyl-17-[(E,2R)-6-methylhept-3-en-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
OPENEYE Name: (3S,8S,9S,10R,13R,14S)-17-[(E,1R)-1,5-dimethylhex-2-enyl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
IUPAC Name: (3S,8S,9S,10R,13R,14S)-10,13-dimethyl-17-[(E,2R)-6-methylhept-3-en-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
SYSTEMATIC NAME: (3S,8S,9S,10R,13R,14S)-10,13-dimethyl-17-[(E,2R)-6-methylhept-3-en-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
MOLECULAR FORMULA: C27H44O
MOLECULAR WEIGHT: 384.63766
SMILES: C[C@H](/C=C/CC(C)C)C1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)O)C)C
Structure:

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