Stigmastadienone(20817-72-5) IR1
Product NameStigmastadienone
CAS20817-72-5
Molecular FormulaC29H46O
Molecular Weight410.68
InChIInChI=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
SmilesC1(=O)C=C2[C@](C)(CC1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](CC1)(C)[C@@H]([C@H](C)/C=C/[C@H](C(C)C)CC)CC3)CC2
