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4-Methylene-3.beta.-hydroxy-A-homo-B,19-di-nor-5.beta.-androst-9-en-17-one 3-benzoate
SpectraBase Compound ID 7jPL2Zw7D93
InChI InChI=1S/C26H30O3/c1-16-20-15-21-19(13-14-26(2)22(21)11-12-24(26)27)18(20)9-6-10-23(16)29-25(28)17-7-4-3-5-8-17/h3-5,7-8,20-23H,1,6,9-15H2,2H3/t20-,21?,22?,23-,26?/m0/s1
InChIKey KVGVVKRJTDHKKP-RRTUNXMHSA-N
Mol Weight 390.52 g/mol
Molecular Formula C26H30O3
Exact Mass 390.219495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AdXVE497yub
Name 4-Methylene-3.beta.-hydroxy-A-homo-B,19-di-nor-5.beta.-androst-9-en-17-one 3-benzoate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H30O3
InChI InChI=1S/C26H30O3/c1-16-20-15-21-19(13-14-26(2)22(21)11-12-24(26)27)18(20)9-6-10-23(16)29-25(28)17-7-4-3-5-8-17/h3-5,7-8,20-23H,1,6,9-15H2,2H3/t20-,21?,22?,23-,26?/m0/s1
InChIKey KVGVVKRJTDHKKP-RRTUNXMHSA-N
Molecular Weight 390.523 g/mol
SMILES C12=C3[C@@](C([C@@](OC(=O)c4ccccc4)(CCC3)[H])=C)([H])CC1C1CCC(C1(CC2)C)=O
SPLASH splash10-014i-0091000000-6d6b90270f38fc0f4f6e
Source of Spectrum G-56-1084-0
Synonyms (9S,10aR)-3a-methyl-10-methylene-3-oxo-2,3,3a,4,5,6,7,8,9,10,10a,11,11a,11b-tetradecahydro-1H-cyclohepta[b]as-indacen-9-yl benzoate 4a-Methyleno-3.beta.-hydroxy-A-homo-B,19-di-nor-5.beta.-androst-9-en-17-one 3-benzoate
Wiley ID 748329