InChI=1/C23H32O2.H2O/c1-5-9-23(25)12-8-19-17-13-15(2)20-14-16(24)6-10-21(20,3)18(17)7-11-22(19,23)4;/h14-15,17-19,25H,6-8,10-13H2,1-4H3;1H2/t15-,17+,18-,19-,21+,22-,23-;/m0./s1

Inherent Properties, Identifiers and References

ChemSpider ID:	58805
Empirical Formula:	C₂₃H₃₄O₃
Molecular Weight:	358.5143
Nominal Mass:	358 Da
Average Mass:	358.5143 Da
Monoisotopic Mass:	358.250795 Da

Systematic Name:

(6S,8R,9S,10R,13S,14S,17S)-17-hydroxy-6,10,13-trimethyl-17-prop-1-yn-1-yl-1,2,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-3H-cyclopenta[a]phenanthren-3-one hydrate (non-preferred name)

SMILES:

O=C4\C=C3/[C@]([C@H]2CC[C@]1([C@@H](CC[C@]1(C#CC)O)[C@@H]2C[C@@H]3C)C)(C)CC4.O Copy

InChI:

InChI=1/C23H32O2.H2O/c1-5-9-23(25)12-8-19-17-13-15(2)20-14-16(24)6-10-21(20,3)18(17)7-11-22(19,23)4;/h14-15,17-19,25H,6-8,10-13H2,1-4H3;1H2/t15-,17+,18-,19-,21+,22-,23-;/m0./s1 Copy

InChIKey:

REHJTMDOJHAPJV-IVTQUDKZBU

Std. InChI:

InChI=1S/C23H32O2.H2O/c1-5-9-23(25)12-8-19-17-13-15(2)20-14-16(24)6-10-21(20,3)18(17)7-11-22(19,23)4;/h14-15,17-19,25H,6-8,10-13H2,1-4H3;1H2/t15-,17+,18-,19-,21+,22-,23-;/m0./s1 Copy

Std. InChIKey:

REHJTMDOJHAPJV-IVTQUDKZSA-N