2,3-SECO-5A-ANDROSTANE-17-ONE-2,3-DIOIC ACID

CAS No.
1165-38-4
CCD No.
CCD00948908
Formula
C19 H28 O5
MolWeight
336.425

Basic Information

Product Name: 2,3-SECO-5A-ANDROSTANE-17-ONE-2,3-DIOIC ACID
CAS: 1165-38-4
English Synonyms: 2,3-SECO-5A-ANDROSTANE-17-ONE-2,3-DIOIC ACID
MDL Number.: MFCD10566709
H bond acceptor: 5
H bond donor: 2
Smile: C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)CC[C@H]([C@]3(C)CC(=O)O)CC(=O)O
InChi: InChI=1S/C19H28O5/c1-18-8-7-14-12(13(18)5-6-15(18)20)4-3-11(9-16(21)22)19(14,2)10-17(23)24/h11-14H,3-10H2,1-2H3,(H,21,22)(H,23,24)/t11-,12-,13-,14-,18-,19-/m0/s1
InChiKey: InChIKey=CEUQHWSIXGFNGI-GHJQBBOJSA-N

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