N-(cyclohexylmethyl)-N-[[(3R,5S,8R,9S,10S,13S,14S)-10,13-dimethyl-3-oxidanyl-17-oxidanylidene-2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]methyl]propanamide

Systemtic Name: N-(cyclohexylmethyl)-N-[[(3R,5S,8R,9S,10S,13S,14S)-10,13-dimethyl-3-oxidanyl-17-oxidanylidene-2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]methyl]propanamide Openeye Name: N-(cyclohexylmethyl)-N-[[(3R,5S,8R,9S,10S,13S,14S)-3-hydroxy-10,13-dimethyl-17-oxo-2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]methyl]propanamide CAS Name: N-(cyclohexylmethyl)-N-[[(3R,5S,8R,9S,10S,13S,14S)-3-hydroxy-10,13-dimethyl-17-oxo-2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]methyl]propanamide IUPAC Name: N-(cyclohexylmethyl)-N-[[(3R,5S,8R,9S,10S,13S,14S)-3-hydroxy-10,13-dimethyl-17-oxo-2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]methyl]propanamide Traditional Name: N-(cyclohexylmethyl)-N-[[(3R,5S,8R,9S,10S,13S,14S)-3-hydroxy-17-keto-10,13-dimethyl-2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]methyl]propionamide Formula: C30H49NO3 MolecularWeight: 471.71496

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(CC1CCCCC1)CC2(CCC3(C(C2)CCC4C3CCC5(C4CCC5=O)C)C)O

Isomeric SMILES

CCC(=O)N(CC1CCCCC1)C[C@]2(CC[C@]3([C@H](C2)CC[C@@H]4[C@@H]3CC[C@]5([C@H]4CCC5=O)C)C)O

InChI

InChI=1S/C30H49NO3/c1-4-27(33)31(19-21-8-6-5-7-9-21)20-30(34)17-16-28(2)22(18-30)10-11-23-24-12-13-26(32)29(24,3)15-14-25(23)28/h21-25,34H,4-20H2,1-3H3/t22-,23-,24-,25-,28-,29-,30+/m0/s1