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Androstane-17-propanoic acid, 3,17-dihydroxy-.alpha.-methylene-, .gamma.-lactone, (3.beta.,5.alpha.,17.alpha.)-
SpectraBase Compound ID BlRpkNJEOWT
InChI InChI=1S/C22H32O3/c1-12-19-18(25-20(12)24)11-17-15-5-4-13-10-14(23)6-8-21(13,2)16(15)7-9-22(17,19)3/h13-19,23H,1,4-11H2,2-3H3/t13-,14-,15+,16-,17-,18+,19+,21-,22-/m0/s1
InChIKey SYCLULFIIIJLOS-JZQNTGEPSA-N
Mol Weight 344.5 g/mol
Molecular Formula C22H32O3
Exact Mass 344.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LSzj9IKtaQi
Name Androstane-17-propanoic acid, 3,17-dihydroxy-.alpha.-methylene-, .gamma.-lactone, (3.beta.,5.alpha.,17.alpha.)-
CAS Registry Number 72166-45-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H32O3
InChI InChI=1S/C22H32O3/c1-12-19-18(25-20(12)24)11-17-15-5-4-13-10-14(23)6-8-21(13,2)16(15)7-9-22(17,19)3/h13-19,23H,1,4-11H2,2-3H3/t13-,14-,15+,16-,17-,18+,19+,21-,22-/m0/s1
InChIKey SYCLULFIIIJLOS-JZQNTGEPSA-N
Molecular Weight 344.495 g/mol
SMILES O[C@]1(CC[C@@]2([C@]3(CC[C@]4([C@]([C@@]3(CC[C@]2(C1)[H])[H])(C[C@@]1([C@]4(C(C(=O)O1)=C)[H])[H])[H])C)[H])C)[H]
SPLASH splash10-004i-0029000000-fa6d8bce7ef9e0bdb171
Source of Spectrum H-62-1600-0
Synonyms (2S,4aS,4bS,6aS,6bR,9aR,10aS,10bR,12aS)-2-hydroxy-4a,6a-dimethyl-7-methyleneoctadecahydro-8H-naphtho[2',1':4,5]indeno[2,1-b]furan-8-one 3.beta.-hydroxy-4'-methylidene-4',5',16.beta.,17.beta.-tetrahydro-5.alpha.-androstano[17,16-b]furan-5'-one Spiro[17H-cyclopenta[a]phenanthrene-17,2'(5'H)-furan], androstane-17-propanoic acid deriv.
Wiley ID 1338246