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18-Nor-16-oxaandrosta-13(17),14-diene-4-carboxylic acid, 4,8-dimethyl-, methyl ester, (4.beta.,5.alpha.)-
SpectraBase Compound ID HdYXHfJNWeM
InChI InChI=1S/C21H30O3/c1-19-11-8-17-20(2,9-5-10-21(17,3)18(22)23-4)16(19)7-6-14-12-24-13-15(14)19/h12-13,16-17H,5-11H2,1-4H3/t16-,17+,19?,20+,21-/m0/s1
InChIKey IGYDONOPDSVEGH-OZMLGJODSA-N
Mol Weight 330.47 g/mol
Molecular Formula C21H30O3
Exact Mass 330.219495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Fqa6X8CsCs
Name 18-Nor-16-oxaandrosta-13(17),14-diene-4-carboxylic acid, 4,8-dimethyl-, methyl ester, (4.beta.,5.alpha.)-
CAS Registry Number 74804-00-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H30O3
InChI InChI=1S/C21H30O3/c1-19-11-8-17-20(2,9-5-10-21(17,3)18(22)23-4)16(19)7-6-14-12-24-13-15(14)19/h12-13,16-17H,5-11H2,1-4H3/t16-,17+,19?,20+,21-/m0/s1
InChIKey IGYDONOPDSVEGH-OZMLGJODSA-N
Molecular Weight 330.468 g/mol
SMILES C12(c3c(coc3)CC[C@@]2([C@]2(CCC[C@@]([C@@]2(CC1)[H])(C(=O)OC)C)C)[H])C
SPLASH splash10-001i-0119000000-3e44b418c5a3353d2d2a
Source of Spectrum AN-89-403-0
Synonyms Methyl (5aR,6S,9aR,9bR)-3b,6,9a-trimethyl-3b,4,5,5a,6,7,8,9,9a,9b,10,11-dodecahydrophenanthro[1,2-c]furan-6-carboxylate Methyl ester of spongia-13(16),14-dien-19-oic acid Phenanthro[1,2-c]furan, 18-nor-16-oxaandrosta-13(17),14-diene-4-carboxylic acid deriv.
Wiley ID 1328261