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2'-[4-(Acetylbenzylidene)]-11-.beta-Hydroxyandrost-4-en[3,2-b]furan
SpectraBase Compound ID DlmjMv0jPLb
InChI InChI=1S/C30H36O3/c1-18(31)20-6-4-19(5-7-20)14-23-15-21-17-30(3)22(16-27(21)33-23)8-9-24-25-10-11-28(32)29(25,2)13-12-26(24)30/h4-7,14-16,22,24-26,28,32H,8-13,17H2,1-3H3/b23-14+/t22?,24?,25?,26?,28-,29?,30?/m0/s1
InChIKey VQFUYUYXJPQFGH-NFRVEFKZSA-N
Mol Weight 444.6 g/mol
Molecular Formula C30H36O3
Exact Mass 444.266445 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2WoXkIdL3WD
Name 2'-[4-(Acetylbenzylidene)]-11-.beta-Hydroxyandrost-4-en[3,2-b]furan
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H36O3
InChI InChI=1S/C30H36O3/c1-18(31)20-6-4-19(5-7-20)14-23-15-21-17-30(3)22(16-27(21)33-23)8-9-24-25-10-11-28(32)29(25,2)13-12-26(24)30/h4-7,14-16,22,24-26,28,32H,8-13,17H2,1-3H3/b23-14+/t22?,24?,25?,26?,28-,29?,30?/m0/s1
InChIKey VQFUYUYXJPQFGH-NFRVEFKZSA-N
Molecular Weight 444.615 g/mol
SMILES O[C@@]1(C2(CCC3C4(CC=5C(O\C(C5)=C/c5ccc(C(=O)C)cc5)=CC4CCC3C2CC1)C)C)[H]
SPLASH splash10-0006-0100900000-0ff294cdd7123644726c
Source of Spectrum F-54-15266-8
Synonyms 2'-[4-(Acetylbenzylidene)]-11-..beta.-Hydroxyandrost-4-en[3,2-b]furan
Wiley ID 809991