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Pregnan-20-one, 5,6-epoxy-3-hydroxy-, (3.beta.,5.alpha.,6.alpha.)-
SpectraBase Compound ID Ics6VR0dyj1
InChI InChI=1S/C21H32O3/c1-12(22)15-4-5-16-14-10-18-21(24-18)11-13(23)6-9-20(21,3)17(14)7-8-19(15,16)2/h13-18,23H,4-11H2,1-3H3
InChIKey QLULPRPVLIPVFS-UHFFFAOYSA-N
Mol Weight 332.5 g/mol
Molecular Formula C21H32O3
Exact Mass 332.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E4YDmOG0Icn
Name Pregnan-20-one, 5,6-epoxy-3-hydroxy-, (3.beta.,5.alpha.,6.alpha.)-
Alternate Name(s) Pregnan-20-one, 5,6-epoxy-3-hydroxy-, (3.beta.,5.beta.,6.beta.)- 1-(3-Hydroxy-9a,11b-dimethylhexadecahydrocyclopenta[1,2]phenanthro[8a,9-b]oxiren-9-yl)ethanone (3beta,5beta,6beta)-5,6-epoxy-3-hydroxypregnan-20-one 5.alpha.-Pregnan-20-one, 5,6.alpha.-epoxy-3.beta.-hydroxy- 5.beta.-Pregnan-20-one, 5,6.beta.-epoxy-3.beta.-hydroxy- EINECS 218-588-4 EINECS 229-515-0
CAS Registry Number 6585-70-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H32O3
InChI InChI=1S/C21H32O3/c1-12(22)15-4-5-16-14-10-18-21(24-18)11-13(23)6-9-20(21,3)17(14)7-8-19(15,16)2/h13-18,23H,4-11H2,1-3H3
InChIKey QLULPRPVLIPVFS-UHFFFAOYSA-N
Molecular Weight 332.484 g/mol
SMILES OC1CC23C(C)(C4C(CC3O2)C2C(CC4)(C(CC2)C(C)=O)C)CC1
SPLASH splash10-0bvi-8941000000-6e8de58a90a0ce092c65
Source of Spectrum AA-0-1955-1
Wiley ID 77998