6BETA-HYDROXYMETHYLANDROSTA-1,4-DIENE-3,17-DIONE

CAS No.
121021-51-0
CCD No.
CCD07563997
Formula
C20 H26 O3
MolWeight
314.422

Basic Information

Product Name: 6BETA-HYDROXYMETHYLANDROSTA-1,4-DIENE-3,17-DIONE
CAS: 121021-51-0
English Synonyms: 6BETA-HYDROXYMETHYLANDROSTA-1,4-DIENE-3,17-DIONE ; EXEMESTANE IMP B
MDL Number.: MFCD22683660
H bond acceptor: 3
H bond donor: 1
Smile: C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)C[C@H](C4=CC(=O)C=C[C@]34C)CO
InChi: InChI=1S/C20H26O3/c1-19-7-5-13(22)10-17(19)12(11-21)9-14-15-3-4-18(23)20(15,2)8-6-16(14)19/h5,7,10,12,14-16,21H,3-4,6,8-9,11H2,1-2H3/t12-,14-,15-,16-,19+,20-/m0/s1
InChiKey: InChIKey=DAXJNUBSBFUTRP-JKNDIDBPSA-N

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