PFAS
全球PFAS筛查数据库
阿法沙龙(alfaxalone)
阿法沙龙
,
3-羟基-5Α-孕烷-11,20-二酮
,
5Α-孕-3Α-醇-11,20-二酮, Alfaxalone, Alphaxalone, MFCD00083468, Cyclothiazide, GR 2/234, 3alpha-Hydroxy-5alpha-pregnane-11,20-dione, 5alpha-Pregnan-3alpha-ol-11,20-dione
CAS号: 23930-19-0
IUPAC名称: (3R,5S,8S,9S,10S,13S,14S,17S)-17-acetyl-3-hydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-11-one
分子式: C21H32O3
分子量: 332.47700
InChI: InChI=1S/C21H32O3/c1-12(22)16-6-7-17-15-5-4-13-10-14(23)8-9-20(13,2)19(15)18(24)11-21(16,17)3/h13-17,19,23H,4-11H2,1-3H3/t13-,14+,15-,16+,17-,19+,20-,21+/m0/s1
InChIKey: DUHUCHOQIDJXAT-OLVMNOGESA-N
SMILES: CC(=O)[C@H]1CC[C@@H]2[C@@]1(CC(=O)[C@H]3[C@H]2CC[C@@H]4[C@@]3(CC[C@H](C4)O)C)C
EINECS: 暂无
