NCS
中国新化学物质查询
氢化可的松3-(O-羧甲基)肟(Cortisol 3-(O-carboxymethyl)oxime)
氢化可的松3-(O-羧甲基)肟, cortisol-3-CMO, cortisol-3-O-carboxymethyl-oxime, ({(Z)-[(3Z,11β)-11,17,21-Trihydroxy-20-oxopregn-4-en-3-ylidene]amino}oxy)acetic acid, Acetic acid, 2-[[[(3Z,11β)-11,17,21-trihydroxy-20-oxopregn-4-en-3-ylidene]amino]oxy]-, Cortisol 3-(O-carboxymethyl)oxime, Hydrocortisone 3-(O-carboxymethyl)oxime, MFCD00056501
CAS号: 43188-86-9
IUPAC名称: 2-[(E)-[(8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-ylidene]amino]oxyacetic acid
分子式: C23H33NO7
分子量: 435.51100
InChI: InChI=1S/C23H33NO7/c1-21-7-5-14(24-31-12-19(28)29)9-13(21)3-4-15-16-6-8-23(30,18(27)11-25)22(16,2)10-17(26)20(15)21/h9,15-17,20,25-26,30H,3-8,10-12H2,1-2H3,(H,28,29)/b24-14+/t15-,16-,17-,20+,21-,22-,23-/m0/s1
InChIKey: WXAWNCDYPXVODT-ZAKIEOBNSA-N
SMILES: C[C@]12CC/C(=N\OCC(=O)O)/C=C1CC[C@@H]3[C@@H]2[C@H](C[C@]4([C@H]3CC[C@@]4(C(=O)CO)O)C)O
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