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D-Homoandrostane-17a-carboxylic acid, 17-hydroxy-4,4,8-trimethyl-, methyl ester, (5.alpha.,17.alpha.,17a.beta.)-
SpectraBase Compound ID 3tSoe0yZvtw
InChI InChI=1S/C25H42O3/c1-22(2)12-7-13-23(3)17(22)10-14-24(4)18-9-8-16(26)20(21(27)28-6)25(18,5)15-11-19(23)24/h16-20,26H,7-15H2,1-6H3
InChIKey OVIXBBGABKWUMS-UHFFFAOYSA-N
Mol Weight 390.6 g/mol
Molecular Formula C25H42O3
Exact Mass 390.313395 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8gAV4xiYI1n
Name D-Homoandrostane-17a-carboxylic acid, 17-hydroxy-4,4,8-trimethyl-, methyl ester, (5.alpha.,17.alpha.,17a.beta.)-
CAS Registry Number 131246-15-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H42O3
InChI InChI=1S/C25H42O3/c1-22(2)12-7-13-23(3)17(22)10-14-24(4)18-9-8-16(26)20(21(27)28-6)25(18,5)15-11-19(23)24/h16-20,26H,7-15H2,1-6H3
InChIKey OVIXBBGABKWUMS-UHFFFAOYSA-N
Molecular Weight 390.608 g/mol
SMILES OC1C(C2(C(C3(CCC4C(C3CC2)(CCCC4(C)C)C)C)CC1)C)C(=O)OC
SPLASH splash10-00nf-8905000000-c836b25e2fb512350c17
Source of Spectrum KC-1990-2549-5
Synonyms Methyl 17-hydroxy-24-norscalaran-25-oate Methyl 2-hydroxy-4b,7,7,10a,12a-pentamethyloctadecahydro-1-chrysenecarboxylate
Wiley ID 1365145