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24-Norchol-22-ene-3,7-diol, diacetate, (3.alpha.,5.beta.,7.alpha.)-
SpectraBase Compound ID A0xlbuvASJx
InChI InChI=1S/C27H42O4/c1-7-16(2)21-8-9-22-25-23(11-13-27(21,22)6)26(5)12-10-20(30-17(3)28)14-19(26)15-24(25)31-18(4)29/h7,16,19-25H,1,8-15H2,2-6H3
InChIKey WCDPVSSBOCZUNL-UHFFFAOYSA-N
Mol Weight 430.6 g/mol
Molecular Formula C27H42O4
Exact Mass 430.30831 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2iphDsDQoka
Name 24-Norchol-22-ene-3,7-diol, diacetate, (3.alpha.,5.beta.,7.alpha.)-
Alternate Name(s) (7-acetyloxy-17-but-3-en-2-yl-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl) acetate (7-acetyloxy-17-but-3-en-2-yl-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl) ethanoate Acetic acid (7-acetyloxy-17-but-3-en-2-yl-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl) ester [7-acetoxy-10,13-dimethyl-17-(1-methylallyl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate
CAS Registry Number 57071-90-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H42O4
InChI InChI=1S/C27H42O4/c1-7-16(2)21-8-9-22-25-23(11-13-27(21,22)6)26(5)12-10-20(30-17(3)28)14-19(26)15-24(25)31-18(4)29/h7,16,19-25H,1,8-15H2,2-6H3
InChIKey WCDPVSSBOCZUNL-UHFFFAOYSA-N
Molecular Weight 430.629 g/mol
SMILES C(OC1C2C(C3(C(C1)CC(OC(C)=O)CC3)C)CCC1(C2CCC1C(C=C)C)C)(C)=O
SPLASH splash10-0a4i-0920000000-b251562f0a7a7cb8021d
Source of Spectrum W5-34856-30680-30680
Wiley ID 1381706