CAS RN: 30511-63-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C29H33NO9
MOLECULAR WEIGHT: 539.57362
SMILES: CO[C@H]1[C@H](C[C@]23CCN[C@]24[C@]1(O[C@@H](C4)C5=C3C(=C(C=C5)OC)O)OC)OC(=O)/C=C\C6=CC(=C(C=C6)OC)O
Structure:
CAS RN: 6730-83-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C20H30O2
MOLECULAR WEIGHT: 302.451
SMILES: C[C@@]12CCC[C@@]([C@H]1CC[C@]34[C@H]2CCC(C3)C(=C)C4)(C)C(=O)O
Structure:
CAS RN: 60723-28-6
CAS Name: N-methyl-N-[(1S)-4-oxocycloheptyl]benzamide
OPENEYE Name: N-methyl-N-[(1S)-4-oxocycloheptyl]benzamide
IUPAC Name: N-methyl-N-[(1S)-4-oxocycloheptyl]benzamide
SYSTEMATIC NAME: N-methyl-N-[(1S)-4-oxidanylidenecycloheptyl]benzamide
MOLECULAR FORMULA: C15H19NO2
MOLECULAR WEIGHT: 245.31686
SMILES: CN([C@H]1CCCC(=O)CC1)C(=O)C2=CC=CC=C2
Structure:
CAS RN: 71339-25-8
CAS Name: (2R)-2-[(1S)-1-[(4S,5R,6S,8R,9S,10R,13S,14R,17S)-6-chloro-4,5,14,17-tetrahydroxy-10,13-dimethyl-1-oxo-6,7,8,9,11,12,15,16-octahydro-4H-cyclopenta[a]phenanthren-17-yl]-1-hydroxyethyl]-4,5-dimethyl-2,3-dihydropyran-6-one
OPENEYE Name: (2R)-2-[(1S)-1-[(4S,5R,6S,8R,9S,10R,13S,14R,17S)-6-chloro-4,5,14,17-tetrahydroxy-10,13-dimethyl-1-oxo-6,7,8,9,11,12,15,16-octahydro-4H-cyclopenta[a]phenanthren-17-yl]-1-hydroxy-ethyl]-4,5-dimethyl-2,3-dihydropyran-6-one
IUPAC Name: (2R)-2-[(1S)-1-[(4S,5R,6S,8R,9S,10R,13S,14R,17S)-6-chloro-4,5,14,17-tetrahydroxy-10,13-dimethyl-1-oxo-6,7,8,9,11,12,15,16-octahydro-4H-cyclopenta[a]phenanthren-17-yl]-1-hydroxyethyl]-4,5-dimethyl-2,3-dihydropyran-6-one
SYSTEMATIC NAME: (2R)-2-[(1S)-1-[(4S,5R,6S,8R,9S,10R,13S,14R,17S)-6-chloranyl-10,13-dimethyl-4,5,14,17-tetrakis(oxidanyl)-1-oxidanylidene-6,7,8,9,11,12,15,16-octahydro-4H-cyclopenta[a]phenanthren-17-yl]-1-oxidanyl-ethyl]-4,5-dimethyl-2,3-dihydropyran-6-one
MOLECULAR FORMULA: C28H39ClO8
MOLECULAR WEIGHT: 539.05746
SMILES: CC1=C(C(=O)O[C@H](C1)[C@@](C)([C@@]2(CC[C@@]3([C@@]2(CC[C@H]4[C@H]3C[C@@H]([C@]5([C@@]4(C(=O)C=C[C@@H]5O)C)O)Cl)C)O)O)O)C
Structure:
CAS RN: 80557-13-7
CAS Name: 2,4-dihydroxy-6-methyl-3-[(E)-3-methyl-6-[5-(2-methylprop-1-enyl)-3-furanyl]hex-2-enyl]benzoic acid
OPENEYE Name: 2,4-dihydroxy-6-methyl-3-[(E)-3-methyl-6-[5-(2-methylprop-1-enyl)-3-furyl]hex-2-enyl]benzoic acid
IUPAC Name: 2,4-dihydroxy-6-methyl-3-[(E)-3-methyl-6-[5-(2-methylprop-1-enyl)furan-3-yl]hex-2-enyl]benzoic acid
SYSTEMATIC NAME: 6-methyl-3-[(E)-3-methyl-6-[5-(2-methylprop-1-enyl)furan-3-yl]hex-2-enyl]-2,4-bis(oxidanyl)benzoic acid
MOLECULAR FORMULA: C23H28O5
MOLECULAR WEIGHT: 384.46542
SMILES: CC1=CC(=C(C(=C1C(=O)O)O)C/C=C(\C)/CCCC2=COC(=C2)C=C(C)C)O
Structure:
CAS RN: 2571-86-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C15H18O5
MOLECULAR WEIGHT: 278.30042
SMILES: CC(=C)[C@@H]1C2C[C@]3([C@@]4(CO4)[C@H]5[C@@H]([C@]3(C1C(=O)O2)O)O5)C
Structure:
CAS RN: 81531-65-9
CAS Name: 1,2,5-trimethyl-6H-pyrido[4,3-b]carbazol-2-ium acetate
OPENEYE Name: 1,2,5-trimethyl-6H-pyrido[4,3-b]carbazol-2-ium acetate
IUPAC Name: 1,2,5-trimethyl-6H-pyrido[4,3-b]carbazol-2-ium acetate
SYSTEMATIC NAME: 1,2,5-trimethyl-6H-pyrido[4,3-b]carbazol-2-ium ethanoate
MOLECULAR FORMULA: C20H20N2O2
MOLECULAR WEIGHT: 320.385
SMILES: CC1=C2C(=CC3=C1C=C[N+](=C3C)C)C4=CC=CC=C4N2.CC(=O)[O-]
Structure:
CAS RN: 18676-07-8
CAS Name: (3S,4R,4aS,8aS)-4-[2-(3-furanyl)ethyl]-4-hydroxy-3,4a,8,8-tetramethyl-1,3,5,6,7,8a-hexahydronaphthalen-2-one
OPENEYE Name: (3S,4R,4aS,8aS)-4-[2-(3-furyl)ethyl]-4-hydroxy-3,4a,8,8-tetramethyl-decalin-2-one
IUPAC Name: (3S,4R,4aS,8aS)-4-[2-(furan-3-yl)ethyl]-4-hydroxy-3,4a,8,8-tetramethyl-1,3,5,6,7,8a-hexahydronaphthalen-2-one
SYSTEMATIC NAME: (3S,4R,4aS,8aS)-4-[2-(furan-3-yl)ethyl]-3,4a,8,8-tetramethyl-4-oxidanyl-1,3,5,6,7,8a-hexahydronaphthalen-2-one
MOLECULAR FORMULA: C20H30O3
MOLECULAR WEIGHT: 318.4504
SMILES: C[C@@H]1C(=O)C[C@@H]2[C@@]([C@]1(CCC3=COC=C3)O)(CCCC2(C)C)C
Structure:
CAS RN: 57517-46-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C28H30O10
MOLECULAR WEIGHT: 526.5318
SMILES: C[C@]12C[C@@H]3[C@]4([C@]56[C@H]1C(=O)C(O5)([C@@H]7CC8C9(O8)CC=CC(=O)[C@@]9([C@H]7CC[C@]6(C(=O)O4)O)C)OC[C@H]2C(=O)O3)C
Structure:
CAS RN: 75747-32-9
CAS Name: N-methylcarbamic acid [(3R,5R,6S,7R,8E,10R,11R,12Z,14E)-6-hydroxy-5,11,21-trimethoxy-3,7,9,15,17-pentamethyl-16,20,22-trioxo-17-azabicyclo[16.3.1]docosa-1(21),8,12,14,18-pentaen-10-yl] ester
OPENEYE Name: [(3R,5R,6S,7R,8E,10R,11R,12Z,14E)-6-hydroxy-5,11,21-trimethoxy-3,7,9,15,17-pentamethyl-16,20,22-trioxo-17-azabicyclo[16.3.1]docosa-1(21),8,12,14,18-pentaen-10-yl] N-methylcarbamate
IUPAC Name: [(3R,5R,6S,7R,8E,10R,11R,12Z,14E)-6-hydroxy-5,11,21-trimethoxy-3,7,9,15,17-pentamethyl-16,20,22-trioxo-17-azabicyclo[16.3.1]docosa-1(21),8,12,14,18-pentaen-10-yl] N-methylcarbamate
SYSTEMATIC NAME: [(3R,5R,6S,7R,8E,10R,11R,12Z,14E)-5,11,21-trimethoxy-3,7,9,15,17-pentamethyl-6-oxidanyl-16,20,22-tris(oxidanylidene)-17-azabicyclo[16.3.1]docosa-1(21),8,12,14,18-pentaen-10-yl] N-methylcarbamate
MOLECULAR FORMULA: C31H44N2O9
MOLECULAR WEIGHT: 588.68906
SMILES: C[C@H]1C[C@H]([C@H]([C@@H](/C=C(/[C@H]([C@@H](/C=C\C=C(\C(=O)N(C2=CC(=O)C(=C(C1)C2=O)OC)C)/C)OC)OC(=O)NC)\C)C)O)OC
Structure:
CAS RN: 75747-14-7
CAS Name: carbamic acid [(3R,5R,6S,7R,8E,10R,11R,12Z,14E)-6-hydroxy-5,11-dimethoxy-3,7,9,15-tetramethyl-16,20,22-trioxo-21-(prop-2-enylamino)-17-azabicyclo[16.3.1]docosa-1(21),8,12,14,18-pentaen-10-yl] ester
OPENEYE Name: [(3R,5R,6S,7R,8E,10R,11R,12Z,14E)-21-(allylamino)-6-hydroxy-5,11-dimethoxy-3,7,9,15-tetramethyl-16,20,22-trioxo-17-azabicyclo[16.3.1]docosa-1(21),8,12,14,18-pentaen-10-yl] carbamate
IUPAC Name: [(3R,5R,6S,7R,8E,10R,11R,12Z,14E)-6-hydroxy-5,11-dimethoxy-3,7,9,15-tetramethyl-16,20,22-trioxo-21-(prop-2-enylamino)-17-azabicyclo[16.3.1]docosa-1(21),8,12,14,18-pentaen-10-yl] carbamate
SYSTEMATIC NAME: [(3R,5R,6S,7R,8E,10R,11R,12Z,14E)-5,11-dimethoxy-3,7,9,15-tetramethyl-6-oxidanyl-16,20,22-tris(oxidanylidene)-21-(prop-2-enylamino)-17-azabicyclo[16.3.1]docosa-1(21),8,12,14,18-pentaen-10-yl] carbamate
MOLECULAR FORMULA: C31H43N3O8
MOLECULAR WEIGHT: 585.68842
SMILES: C[C@H]1C[C@H]([C@H]([C@@H](/C=C(/[C@H]([C@@H](/C=C\C=C(\C(=O)NC2=CC(=O)C(=C(C1)C2=O)NCC=C)/C)OC)OC(=O)N)\C)C)O)OC
Structure:
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