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5ALPHA-ANDROSTAN-3ALPHA,11BETA-DIOL-17-ONE 3-GLUCOSIDURONATE

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Name: 5ALPHA-ANDROSTAN-3ALPHA,11BETA-DIOL-17-ONE 3-GLUCOSIDURONATE
CAS: 35259-60-0
Synonyms: 5ALPHA-ANDROSTANE-3ALPHA,11BETA-DIOL-17-ONE 3-GLUCURONIDE ; 11BETA-HYDROXYANDROSTERONE GLUCURONIDE ; 5ALPHA-ANDROSTAN-3ALPHA,11BETA-DIOL-17-ONE 3-GLUCOSIDURONATE
MDL.: MFCD00271091
H bond acceptor: 9
H bond donor: 5
Smile: C[C@]12CC[C@H](C[C@@H]1CC[C@@H]3[C@@H]2[C@H](C[C@]4([C@H]3CCC4=O)C)O)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)C(=O)O)O)O)O
InChi: InChI=1S/C25H38O9/c1-24-8-7-12(33-23-20(30)18(28)19(29)21(34-23)22(31)32)9-11(24)3-4-13-14-5-6-16(27)25(14,2)10-15(26)17(13)24/h11-15,17-21,23,26,28-30H,3-10H2,1-2H3,(H,31,32)/t11-,12+,13-,14-,15-,17+,18-,19-,20+,21-,23+,24-,25-/m0/s1
InChiKey: InChIKey=BRPLOVMHAFXVOQ-HUMIJZDLSA-N

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