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5.alpha.-Stigmasta-7,22-dien-3-one
SpectraBase Compound ID gb8RFxKbGu
InChI 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/h8-9,11,19-22,25-27H,7,10,12-18H2,1-6H3/b9-8+
InChIKey DZUAZCZFSVNHEF-CMDGGOBGSA-N
Mol Weight 410.7 g/mol
Molecular Formula C29H46O
Exact Mass 410.354866 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HF9pO0bPZot
Name 5.alpha.-Stigmasta-7,22-dien-3-one
CAS Registry Number 23455-44-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H46O
InChI 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/h8-9,11,19-22,25-27H,7,10,12-18H2,1-6H3/b9-8+
InChIKey DZUAZCZFSVNHEF-CMDGGOBGSA-N
Molecular Weight 410.686 g/mol
SMILES C=12C3C(C(C(\C=C\C(C(C)C)CC)C)CC3)(C)CCC2C2(CCC(CC2CC1)=O)C
SPLASH splash10-014i-0391100000-e225ec8c9a2c71b22ce4
Source of Spectrum W5-1989-12430-1
Synonyms Stigmasta-7,22-dien-3-one, (5.alpha.,22E)- (22E)-Stigmasta-7,22-dien-3-one .alpha.-Spinasterone 17-[(E)-4-ethyl-1,5-dimethyl-hex-2-enyl]-10,13-dimethyl-1,2,4,5,6,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one 17-[(E)-5-ethyl-6-methyl-hept-3-en-2-yl]-10,13-dimethyl-1,2,4,5,6,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one Spinasterone Stigmastadienone
Wiley ID 1373905