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D-Homopregn-4-ene-3,20-dione, 12,15-dihydroxy-, (12.beta.,15.alpha.)-
SpectraBase Compound ID I4H2NZgorNj
InChI InChI=1S/C22H32O4/c1-12(23)16-6-7-18(25)20-15-5-4-13-10-14(24)8-9-21(13,2)17(15)11-19(26)22(16,20)3/h10,15-20,25-26H,4-9,11H2,1-3H3/t15?,16?,17?,18-,19+,20?,21-,22?/m0/s1
InChIKey GJHUYMUMDZCPFL-HEZKFDQMSA-N
Mol Weight 360.5 g/mol
Molecular Formula C22H32O4
Exact Mass 360.23006 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HwUYM5JHGJw
Name D-Homopregn-4-ene-3,20-dione, 12,15-dihydroxy-, (12.beta.,15.alpha.)-
CAS Registry Number 72921-23-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H32O4
InChI InChI=1S/C22H32O4/c1-12(23)16-6-7-18(25)20-15-5-4-13-10-14(24)8-9-21(13,2)17(15)11-19(26)22(16,20)3/h10,15-20,25-26H,4-9,11H2,1-3H3/t15?,16?,17?,18-,19+,20?,21-,22?/m0/s1
InChIKey GJHUYMUMDZCPFL-HEZKFDQMSA-N
Molecular Weight 360.494 g/mol
SMILES O[C@]1(C2(C([C@](CCC2C(=O)C)(O)[H])C2CCC=3[C@@](C2C1)(CCC(C3)=O)C)C)[H]
SPLASH splash10-006w-2295000000-805ab0f34dd30eb66f6d
Source of Spectrum K-113-214-0
Synonyms (4aR,6R,10S)-7-acetyl-6,10-dihydroxy-4a,6a-dimethyl-4,4a,4b,5,6,6a,7,8,9,10,10a,10b,11,12-tetradecahydro-2(3H)-chrysenone 12.beta.,15.alpha.-dihydroxy-D-homo-4-pregnen-3,20-dione
Wiley ID 1348545