GP120-W61D-75_化学云数据库

GP120-W61D-75

基本信息
产品名称：	GP120-W61D-75
英文同义词：	H-LEU-ASN-GLU-SER-VAL-ALA-ILE-ASN-CYS-THR-ARG-PRO-ASN-ASN-ASN-OH ; GP120-W61D-75 ; LNESVAINCTRPNNN
MDL号：	MFCD03790112
氢键受体数量：	48
氢键供体数量：	26
Smile：	CC[C@H](C)[C@@H](C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CS)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CC(=O)N)C(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CC(C)C)N
InChi：	InChI=1S/C66H111N23O25S/c1-9-28(6)49(87-51(99)29(7)76-61(109)48(27(4)5)86-58(106)39(24-90)84-53(101)32(14-15-47(97)98)77-54(102)34(19-42(68)92)79-52(100)31(67)18-26(2)3)62(110)82-37(22-45(71)95)57(105)85-40(25-115)59(107)88-50(30(8)91)63(111)78-33(12-10-16-75-66(73)74)64(112)89-17-11-13-41(89)60(108)81-36(21-44(70)94)55(103)80-35(20-43(69)93)56(104)83-38(65(113)114)23-46(72)96/h26-41,48-50,90-91,115H,9-25,67H2,1-8H3,(H2,68,92)(H2,69,93)(H2,70,94)(H2,71,95)(H2,72,96)(H,76,109)(H,77,102)(H,78,111)(H,79,100)(H,80,103)(H,81,108)(H,82,110)(H,83,104)(H,84,101)(H,85,105)(H,86,106)(H,87,99)(H,88,107)(H,97,98)(H,113,114)(H4,73,74,75)/t28-,29-,30+,31-,32-,33-,34-,35-,36-,37-,38-,39-,40-,41-,48-,49-,50-/m0/s1
InChiKey：	InChIKey=TVXPDMRBUVLDIR-VSAXDKNKSA-N

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