GP120-W61D-78

CAS号
CCD编号
CCD00416184
分子式
C66 H113 N27 O20
分子量
1604.79

基本信息

产品名称: GP120-W61D-78
英文同义词: NNNTRKGIHIGPGRA ; GP120-W61D-78 ; H-ASN-ASN-ASN-THR-ARG-LYS-GLY-ILE-HIS-ILE-GLY-PRO-GLY-ARG-ALA-OH
MDL号: MFCD03790115
氢键受体数量: 47
氢键供体数量: 27
Smile: CC[C@H](C)[C@@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H]([C@@H](C)CC)C(=O)NCC(=O)N2CCC[C@H]2C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CC(=O)N)N
InChi: InChI=1S/C66H113N27O20/c1-7-31(3)50(61(109)81-29-49(100)93-21-13-17-43(93)60(108)80-27-47(98)84-38(15-11-19-77-65(72)73)55(103)83-33(5)64(112)113)91-58(106)40(22-35-26-76-30-82-35)89-62(110)51(32(4)8-2)90-48(99)28-79-54(102)37(14-9-10-18-67)85-56(104)39(16-12-20-78-66(74)75)86-63(111)52(34(6)94)92-59(107)42(25-46(71)97)88-57(105)41(24-45(70)96)87-53(101)36(68)23-44(69)95/h26,30-34,36-43,50-52,94H,7-25,27-29,67-68H2,1-6H3,(H2,69,95)(H2,70,96)(H2,71,97)(H,76,82)(H,79,102)(H,80,108)(H,81,109)(H,83,103)(H,84,98)(H,85,104)(H,86,111)(H,87,101)(H,88,105)(H,89,110)(H,90,99)(H,91,106)(H,92,107)(H,112,113)(H4,72,73,77)(H4,74,75,78)/t31-,32-,33-,34+,36-,37-,38-,39-,40-,41-,42-,43-,50-,51-,52-/m0/s1
InChiKey: InChIKey=YWBDCOCGMOZJHQ-QRBZDTBSSA-N

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