(3R,5S)-5-(2-methylpropyl)-3-[(3S,8S,10S,17S)-4,4,8,10,13-pentamethyl-3,7-bis(oxidanyl)-2,3,5,6,7,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]oxolan-2-one

Systemtic Name: (3R,5S)-5-(2-methylpropyl)-3-[(3S,8S,10S,17S)-4,4,8,10,13-pentamethyl-3,7-bis(oxidanyl)-2,3,5,6,7,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]oxolan-2-one Openeye Name: (3R,5S)-3-[(3S,8S,10S,17S)-3,7-dihydroxy-4,4,8,10,13-pentamethyl-2,3,5,6,7,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-5-isobutyl-tetrahydrofuran-2-one CAS Name: (3R,5S)-3-[(3S,8S,10S,17S)-3,7-dihydroxy-4,4,8,10,13-pentamethyl-2,3,5,6,7,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-5-(2-methylpropyl)-2-oxolanone IUPAC Name: (3R,5S)-3-[(3S,8S,10S,17S)-3,7-dihydroxy-4,4,8,10,13-pentamethyl-2,3,5,6,7,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-5-(2-methylpropyl)oxolan-2-one Traditional Name: (3R,5S)-3-[(3S,8S,10S,17S)-3,7-dihydroxy-4,4,8,10,13-pentamethyl-2,3,5,6,7,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-5-isobutyl-tetrahydrofuran-2-one Formula: C30H50O4 MolecularWeight: 474.7156

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1CC(C(=O)O1)C2CCC3C2(CCC4C3(C(CC5C4(CCC(C5(C)C)O)C)O)C)C

Isomeric SMILES

CC(C)C[C@H]1C[C@@H](C(=O)O1)[C@@H]2CCC3C2(CCC4[C@]3(C(CC5[C@@]4(CC[C@@H](C5(C)C)O)C)O)C)C

InChI

InChI=1S/C30H50O4/c1-17(2)14-18-15-19(26(33)34-18)20-8-9-21-28(20,5)12-10-22-29(6)13-11-24(31)27(3,4)23(29)16-25(32)30(21,22)7/h17-25,31-32H,8-16H2,1-7H3/t18-,19+,20-,21?,22?,23?,24-,25?,28?,29+,30-/m0/s1