TYR-GLY (NLE28,31) - CCK 26-33

CAS号
CCD编号
CCD00540114
分子式
C62 H78 N12 O19 S
分子量
1327.43

基本信息

产品名称: TYR-GLY (NLE28,31) - CCK 26-33
英文同义词: TYR-GLY (NLE28,31)-CHOLECYSTOKININ 26-33 ; TYR-GLY (NLE28,31) - CCK 26-33
MDL号: MFCD06408011
氢键受体数量: 31
氢键供体数量: 16
Smile: CCCC[C@@H](C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2c1cccc2)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc3ccccc3)C(=O)N)NC(=O)[C@H](Cc4ccc(cc4)OS(=O)(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@H](Cc5ccc(cc5)O)N
InChi: InChI=1S/C62H78N12O19S/c1-3-5-15-44(70-59(86)47(28-37-20-24-40(25-21-37)93-94(90,91)92)73-61(88)49(30-53(78)79)69-51(76)33-66-56(83)42(63)26-36-18-22-39(75)23-19-36)57(84)67-34-52(77)68-48(29-38-32-65-43-17-11-10-14-41(38)43)60(87)71-45(16-6-4-2)58(85)74-50(31-54(80)81)62(89)72-46(55(64)82)27-35-12-8-7-9-13-35/h7-14,17-25,32,42,44-50,65,75H,3-6,15-16,26-31,33-34,63H2,1-2H3,(H2,64,82)(H,66,83)(H,67,84)(H,68,77)(H,69,76)(H,70,86)(H,71,87)(H,72,89)(H,73,88)(H,74,85)(H,78,79)(H,80,81)(H,90,91,92)/t42-,44-,45-,46-,47-,48-,49-,50-/m0/s1
InChiKey: InChIKey=CPGSKSQPYSLQIX-NGGADEPDSA-N

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