阿基瑞林

CAS号
616204-22-9
CCD编号
CCD08234733
分子式
C34 H60 N14 O12 S . C2 H4 O2
分子量
949.052

基本信息

产品名称: 阿基瑞林
CAS: 616204-22-9
中文同义词: 阿基瑞林
英文同义词: ARGIRELINE ; ARGIRELINE ACETATE ; ARGRELINE ACETATE
MDL号: MFCD10566750
氢键受体数量: 26
氢键供体数量: 16
Smile: CC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N.CC(=O)O
InChi: InChI=1S/C34H60N14O12S.C2H4O2/c1-17(49)43-20(8-11-25(51)52)29(57)47-22(9-12-26(53)54)31(59)48-23(13-16-61-2)32(60)46-21(7-10-24(35)50)30(58)45-19(6-4-15-42-34(39)40)28(56)44-18(27(36)55)5-3-14-41-33(37)38;1-2(3)4/h18-23H,3-16H2,1-2H3,(H2,35,50)(H2,36,55)(H,43,49)(H,44,56)(H,45,58)(H,46,60)(H,47,57)(H,48,59)(H,51,52)(H,53,54)(H4,37,38,41)(H4,39,40,42);1H3,(H,3,4)/t18-,19-,20-,21-,22-,23-;/m0./s1
InChiKey: InChIKey=KUOYHRQPSCEGDA-PXILYFGCSA-N

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