Pregnane-3,20-dione,17,21-dihydroxy-, (5a)-(312-99-2)名称与标识符
名称
英文别名:
Pregnane-3,20-dione,17,21-dihydroxy-, (5a)-;1-((3S,5S,10S,13S,17S)-3-hydroxy-10,13-dimethylhexadecahydro-1H cyclopenta[a]phenanthren-17-yl)ethanone;3-Hydroxypregnan-20-one;5A-PREGNAN-3B-OL-20-ONE;Alloepipregnanolone;ALLOPREGNAN-3B-OL-20-ONE;ALLOPREGNANOLONE;epi-allopregnanolone;Isopregnanolone;Tetrahydroprogesterone;5alpha-pregnane-17alpha-21-diol-3,20-dione;312-99-2;CHEMBL1077918;5alpha-Pregnan-17,21-diol-3,20-dione;17alpha,21-dihydroxy-5alpha-pregnan-3,20-dione;
标识符
InChIKey:
WNIBSYGPDJBVOA-ROQVDZSBSA-N
Inchi:
1S/C21H32O4/c1-19-8-5-14(23)11-13(19)3-4-15-16(19)6-9-20(2)17(15)7-10-21(20,25)18(24)12-22/h13,15-17,22,25H,3-12H2,1-2H3/t13-,15+,16-,17-,19-,20-,21-/m0/s1
SMILES:
O[C@]1(C(CO)=O)CC[C@@H]2[C@]1(C)CC[C@@H]1[C@@]3(C)CCC(C[C@@H]3CC[C@@H]21)=O