7-[(2S)-2-[(3S,8S,9S,10R,13S,14S,17R)-10,13-dimethyl-3-oxidanyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentan-3-yl]oxyphenoxazin-3-one

Systemtic Name: 7-[(2S)-2-[(3S,8S,9S,10R,13S,14S,17R)-10,13-dimethyl-3-oxidanyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentan-3-yl]oxyphenoxazin-3-one Openeye Name: 7-[(2S)-1-ethyl-2-[(3S,8S,9S,10R,13S,14S,17R)-3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]propoxy]phenoxazin-3-one CAS Name: 7-[(2S)-2-[(3S,8S,9S,10R,13S,14S,17R)-3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentan-3-yl]oxy-3-phenoxazinone IUPAC Name: 7-[(2S)-2-[(3S,8S,9S,10R,13S,14S,17R)-3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentan-3-yl]oxyphenoxazin-3-one Traditional Name: 7-[(2S)-1-ethyl-2-[(3S,8S,9S,10R,13S,14S,17R)-3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]propoxy]phenoxazin-3-one Formula: C36H45NO4 MolecularWeight: 555.7468

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)OC5=CC6=C(C=C5)N=C7C=CC(=O)C=C7O6

Isomeric SMILES

CCC([C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)O)C)C)OC5=CC6=C(C=C5)N=C7C=CC(=O)C=C7O6

InChI

InChI=1S/C36H45NO4/c1-5-32(40-25-8-13-31-34(20-25)41-33-19-23(38)7-12-30(33)37-31)21(2)27-10-11-28-26-9-6-22-18-24(39)14-16-35(22,3)29(26)15-17-36(27,28)4/h6-8,12-13,19-21,24,26-29,32,39H,5,9-11,14-18H2,1-4H3/t21-,24-,26-,27+,28-,29-,32?,35-,36+/m0/s1