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5.alpha.-Cholest-22-en-16-one, (Z)-
SpectraBase Compound ID 74jJa4euQ8B
InChI InChI=1S/C27H44O/c1-18(2)9-8-10-19(3)25-24(28)17-23-21-13-12-20-11-6-7-15-26(20,4)22(21)14-16-27(23,25)5/h8,10,18-23,25H,6-7,9,11-17H2,1-5H3/b10-8-
InChIKey LSZPVTKRHUBUAV-NTMALXAHSA-N
Mol Weight 384.6 g/mol
Molecular Formula C27H44O
Exact Mass 384.339216 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EmbHkmkikCj
Name 5.alpha.-Cholest-22-en-16-one, (Z)-
Alternate Name(s) (22Z)-Cholest-22-en-16-one 10,13-dimethyl-17-[(Z)-6-methylhept-3-en-2-yl]-1,2,3,4,5,6,7,8,9,11,12,14,15,17-tetradecahydrocyclopenta[a]phenanthren-16-one 17-[(Z)-1,5-dimethylhex-2-enyl]-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,17-tetradecahydrocyclopenta[a]phenanthren-16-one
CAS Registry Number 14949-13-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H44O
InChI InChI=1S/C27H44O/c1-18(2)9-8-10-19(3)25-24(28)17-23-21-13-12-20-11-6-7-15-26(20,4)22(21)14-16-27(23,25)5/h8,10,18-23,25H,6-7,9,11-17H2,1-5H3/b10-8-
InChIKey LSZPVTKRHUBUAV-NTMALXAHSA-N
Molecular Weight 384.648 g/mol
SMILES CC(C)C\C=C/C(C)C1C(=O)CC2C3CCC4CCCCC4(C)C3CCC12C
SPLASH splash10-0aor-7966000000-20898232ecb17e2c039a
Source of Spectrum SD-1981-0-0
Wiley ID 55697