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别孕烯醇酮
Alloepipregnanolone
ALLOPREGNAN-3B-OL-20-ONE, 3beta-hydroxy-5alpha-pregnan-20-one, 3-Hydroxypregnan-20-one, Alloepipregnanolone, 5A-PREGNAN-3B-OL-20-ONE, Tetrahydroprogesterone, ALLOPREGNANOLONE, ISOPREGNANOLONE, EINECS 208-224-2, MFCD00064935, Pregnan-20-one,3-hydroxy-, (3b,5a)-, epi-allopregnanolone
CAS号: 516-55-2
IUPAC名称: 1-[(3S,5S,8R,9S,10S,13S,14S,17S)-3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone
分子式: C21H34O2
分子量: 318.49300
InChI: InChI=1S/C21H34O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h14-19,23H,4-12H2,1-3H3/t14-,15-,16-,17+,18-,19-,20-,21+/m0/s1
InChIKey: AURFZBICLPNKBZ-FZCSVUEKSA-N
SMILES: CC(=O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(CC[C@@H](C4)O)C)C
EINECS: -
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