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(20R)-3.beta.-Acetoxy-6.alpha.,20-dihydroxypregn-7-ene
SpectraBase Compound ID Hno6dx5OkKK
InChI InChI=1S/C23H36O4/c1-13(24)17-5-6-18-16-12-21(26)20-11-15(27-14(2)25)7-9-23(20,4)19(16)8-10-22(17,18)3/h12-13,15,17-21,24,26H,5-11H2,1-4H3/t13-,15+,17-,18?,19?,20-,21+,22-,23-/m1/s1
InChIKey JAZAXRLDWCCFHT-MWSZZIRPSA-N
Mol Weight 376.5 g/mol
Molecular Formula C23H36O4
Exact Mass 376.26136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5BXozMbMgnP
Name (20R)-3.beta.-Acetoxy-6.alpha.,20-dihydroxypregn-7-ene
Alternate Name(s) (3beta,6alpha,20R)-6,20-dihydroxypregn-7-en-3-yl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H36O4
InChI InChI=1S/C23H36O4/c1-13(24)17-5-6-18-16-12-21(26)20-11-15(27-14(2)25)7-9-23(20,4)19(16)8-10-22(17,18)3/h12-13,15,17-21,24,26H,5-11H2,1-4H3/t13-,15+,17-,18?,19?,20-,21+,22-,23-/m1/s1
InChIKey JAZAXRLDWCCFHT-MWSZZIRPSA-N
Molecular Weight 376.537 g/mol
SMILES O[C@@]1([C@]2(C[C@](CC[C@@]2(C2C(C3[C@@]([C@@]([C@](O)(C)[H])(CC3)[H])(CC2)C)=C1)C)(OC(=O)C)[H])[H])[H]
SPLASH splash10-00l2-0095000000-e39af5e9e28833bb18fc
Source of Spectrum F-49-8602-11
Wiley ID 788317