NCS
中国新化学物质查询
5-Alpha-孕烷-3-beta, 17,21-三醇-11,20-二酮(3alpha,17,21-trihydroxy-5alpha-pregnane-11,20-dione)
allotetrahydrocortisone, 5|A-Dihydrocorticosterone, 5|A-Pregnane-11|A,21-diol-3,20-dione, 5beta-Dihydrocorticosterone, 5alpha-Dihydrocorticosterone, Pregnane-3,20-dione,11,21-dihydroxy-,(5alpha,11beta), 5-Dihydrocorticosterone
CAS号: 547-77-3
IUPAC名称: (3R,5S,8S,9S,10S,13S,14S,17R)-3,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,3,4,5,6,7,8,9,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-11-one
分子式: C21H32O5
分子量: 364.47600
InChI: InChI=1S/C21H32O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h12-15,18,22-23,26H,3-11H2,1-2H3/t12-,13+,14-,15-,18+,19-,20-,21-/m0/s1
InChIKey: SYGWGHVTLUBCEM-TUJFWAKLSA-N
SMILES: C[C@]12CC[C@H](C[C@@H]1CC[C@@H]3[C@@H]2C(=O)C[C@]4([C@H]3CC[C@@]4(C(=O)CO)O)C)O
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