GP120-W61D-60

CAS号
CCD编号
CCD00416166
分子式
C66 H108 N20 O23 S2
分子量
1613.83

基本信息

产品名称: GP120-W61D-60
英文同义词: H-CYS-ASN-ASN-LYS-THR-PHE-ASP-GLY-LYS-GLY-LEU-CYS-THR-ASN-VAL-OH ; CNNKTFDGKGLCTNV ; GP120-W61D-60
MDL号: MFCD03790097
氢键受体数量: 43
氢键供体数量: 24
Smile: CC(C)C[C@@H](C(=O)N[C@@H](CS)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](C(C)C)C(=O)O)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CS)N
InChi: InChI=1S/C66H108N20O23S2/c1-30(2)20-38(58(100)83-44(29-111)63(105)86-53(33(6)88)65(107)82-42(24-47(72)91)62(104)84-51(31(3)4)66(108)109)76-49(93)27-73-55(97)36(16-10-12-18-67)75-48(92)26-74-56(98)43(25-50(94)95)80-59(101)39(21-34-14-8-7-9-15-34)81-64(106)52(32(5)87)85-57(99)37(17-11-13-19-68)77-60(102)41(23-46(71)90)79-61(103)40(22-45(70)89)78-54(96)35(69)28-110/h7-9,14-15,30-33,35-44,51-53,87-88,110-111H,10-13,16-29,67-69H2,1-6H3,(H2,70,89)(H2,71,90)(H2,72,91)(H,73,97)(H,74,98)(H,75,92)(H,76,93)(H,77,102)(H,78,96)(H,79,103)(H,80,101)(H,81,106)(H,82,107)(H,83,100)(H,84,104)(H,85,99)(H,86,105)(H,94,95)(H,108,109)/t32-,33-,35+,36+,37+,38+,39+,40+,41+,42+,43+,44+,51+,52+,53+/m1/s1
InChiKey: InChIKey=JEEDJRQONMLJIO-RPQIAMSSSA-N

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