雌二醇双[4-[二(2-氯乙基)氨基]苯乙酸]酯

pro_cas
22966-79-6
pro_cdbregno
CCD00247557
pro_formula
C42 H50 Cl4 N2 O4
pro_molWeight
788.679

basic_info

Product_Name: 雌二醇双[4-[二(2-氯乙基)氨基]苯乙酸]酯
CAS: 22966-79-6
中文同义词: 雌二醇双[4-[二(2-氯乙基)氨基]苯乙酸]酯 ; (17b)-雌甾-1,3,5(10)-三烯-3,17b-二醇双[4-[二(2-氯乙基)氨基]苯乙酸]酯
EnglishSynonyms: ESTRADIOL BIS[4-[BIS(2-CHLOROETHYL)AMINO]BENZENEACETATE]
pro_mdlNumber: MFCD01729109
pro_acceptors: 6
pro_donors: 0
pro_smile: C[C@]12CC[C@@H]3c4ccc(cc4CC[C@H]3[C@@H]1CC[C@@H]2OC(=O)Cc5ccc(cc5)N(CCCl)CCCl)OC(=O)Cc6ccc(cc6)N(CCCl)CCCl
InChi: InChI=1S/C42H50Cl4N2O4/c1-42-17-16-36-35-13-11-34(51-40(49)26-29-2-7-32(8-3-29)47(22-18-43)23-19-44)28-31(35)6-12-37(36)38(42)14-15-39(42)52-41(50)27-30-4-9-33(10-5-30)48(24-20-45)25-21-46/h2-5,7-11,13,28,36-39H,6,12,14-27H2,1H3/t36-,37-,38+,39+,42+/m1/s1
InChiKey: InChIKey=LRSFXIJGHRPOQQ-VZRQQIPSSA-N

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