Stigmastadienone
[CAS# 20817-72-5]

Identification

• Name: Stigmastadienone
• Synonyms: (8S,9S,10R,13R,14S,17R)-17-[(E,1R,4S)-4-Ethyl-1,5-Dimethyl-Hex-2-Enyl]-10,13-Dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-Dodecahydrocyclopenta[A]Phenanthren-3-One; (8S,9S,10R,13R,14S,17R)-17-[(E,1R,4S)-4-Ethyl-1,5-Dimethylhex-2-Enyl]-10,13-Dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-Dodecahydrocyclopenta[A]Phenanthren-3-One; (8S,9S,10R,13R,14S,17R)-17-[(E,2R,5S)-5-Ethyl-6-Methyl-Hept-3-En-2-Yl]-10,13-Dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-Dodecahydrocyclopenta[A]Phenanthren-3-One
• Molecular Formula: C₂₉H₄₆O
• Molecular Weight: 410.68
• CAS Registry Number: 20817-72-5
• SMILES: [C@@]14(C)[C@H]([C@H]3[C@H](CC1)[C@]2(C)C(=CC(CC2)=O)CC3)CC[C@@H]4[C@@H](\C=C\[C@H](C(C)C)CC)C
• InChI: 1S/C29H46O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h8-9,18-21,24-27H,7,10-17H2,1-6H3/b9-8+/t20-,21-,24+,25-,26+,27+,28+,29-/m1/s1
• InChIKey: MKGZDUKUQPPHFM-LPJPOILFSA-N