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20-BETA-HYDROXY-21-ACETYLPREGNA-4,6-DIEN-3-ONE
SpectraBase Compound ID FbhmBWd8bua
InChI InChI=1S/C23H32O4/c1-14(24)27-13-21(26)20-7-6-18-17-5-4-15-12-16(25)8-10-22(15,2)19(17)9-11-23(18,20)3/h4-5,12,17-21,26H,6-11,13H2,1-3H3/t17?,18?,19?,20-,21+,22+,23+/m1/s1
InChIKey BIEXKSLTFPOJHF-YDVKCTKDSA-N
Mol Weight 372.5 g/mol
Molecular Formula C23H32O4
Exact Mass 372.23006 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6WJO1fOXI0H
Name 20.beta.-Hydroxy-21-acetyloxypregna-4,6-dien-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H32O4
InChI InChI=1S/C23H32O4/c1-14(24)27-13-21(26)20-7-6-18-17-5-4-15-12-16(25)8-10-22(15,2)19(17)9-11-23(18,20)3/h4-5,12,17-21,26H,6-11,13H2,1-3H3/t17?,18?,19?,20-,21+,22+,23+/m1/s1
InChIKey BIEXKSLTFPOJHF-YDVKCTKDSA-N
Molecular Weight 372.505 g/mol
SMILES O[C@]([C@@]1([C@@]2(C(C3C=CC=4[C@@](C3CC2)(CCC(=O)C4)C)CC1)C)[H])(COC(=O)C)[H]
SPLASH splash10-004l-0091000000-418cb4f452ecaf87fe96
Source of Spectrum X2-68-1498-19
Synonyms 20-hydroxy-3-oxopregna-4,6-dien-21-yl acetate 20.beta.-Hydroxy-21-acetylpregna-4,6-dien-3-one
Wiley ID 1609733