GASTRIN, BIG- (G34,1-17), HUMAN

CAS号
CCD编号
CCD00285072
分子式
C79 H126 N22 O23
分子量
1752.0

基本信息

产品名称: GASTRIN, BIG- (G34,1-17), HUMAN
英文同义词: GASTRIN, BIG- (G34,1-17), HUMAN
MDL号: MFCD02093353
氢键受体数量: 45
氢键供体数量: 20
Smile: CC(C)C[C@@H](C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)N)C(=O)NCC(=O)N2CCC[C@H]2C(=O)N3CCC[C@H]3C(=O)N[C@@H](Cc4c[nH]cn4)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N5CCC[C@H]5C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)NC(=O)[C@@H]6CCC(=O)N6
InChi: InChI=1S/C79H126N22O23/c1-41(2)32-50(92-69(113)48-23-25-60(104)88-48)67(111)85-37-61(105)98-28-12-18-55(98)73(117)90-47(22-24-59(82)103)66(110)84-38-62(106)99-29-15-21-58(99)78(122)101-31-14-20-57(101)74(118)94-52(34-45-36-83-40-86-45)70(114)93-51(33-42(3)4)71(115)97-64(43(5)6)76(120)87-44(7)65(109)95-53(35-63(107)108)77(121)100-30-13-19-56(100)75(119)96-54(39-102)72(116)89-46(16-8-10-26-80)68(112)91-49(79(123)124)17-9-11-27-81/h36,40-44,46-58,64,102H,8-35,37-39,80-81H2,1-7H3,(H2,82,103)(H,83,86)(H,84,110)(H,85,111)(H,87,120)(H,88,104)(H,89,116)(H,90,117)(H,91,112)(H,92,113)(H,93,114)(H,94,118)(H,95,109)(H,96,119)(H,97,115)(H,107,108)(H,123,124)/t44-,46-,47-,48-,49-,50-,51-,52-,53-,54-,55-,56-,57-,58-,64-/m0/s1
InChiKey: InChIKey=QZZCJQGUFAZGPN-DFUPPVEZSA-N

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