GP120-W61D-33_化学云数据库

GP120-W61D-33

基本信息
产品名称：	GP120-W61D-33
英文同义词：	GP120-W61D-33 ; DCDDVNTTNSTTTTS ; H-ASP-CYS-ASP-ASP-VAL-ASN-THR-THR-ASN-SER-THR-THR-THR-THR-SER-OH
MDL号：	MFCD03790070
氢键受体数量：	49
氢键供体数量：	29
Smile：	CC(C)[C@@H](C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CO)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CO)C(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CS)NC(=O)[C@H](CC(=O)O)N
InChi：	InChI=1S/C58H95N17O32S/c1-17(2)37(69-48(96)28(13-36(90)91)62-46(94)27(12-35(88)89)63-50(98)31(16-108)68-44(92)24(59)9-34(86)87)51(99)64-26(11-33(61)85)47(95)70-40(20(5)80)54(102)72-38(18(3)78)52(100)65-25(10-32(60)84)45(93)66-29(14-76)49(97)71-41(21(6)81)55(103)74-43(23(8)83)57(105)75-42(22(7)82)56(104)73-39(19(4)79)53(101)67-30(15-77)58(106)107/h17-31,37-43,76-83,108H,9-16,59H2,1-8H3,(H2,60,84)(H2,61,85)(H,62,94)(H,63,98)(H,64,99)(H,65,100)(H,66,93)(H,67,101)(H,68,92)(H,69,96)(H,70,95)(H,71,97)(H,72,102)(H,73,104)(H,74,103)(H,75,105)(H,86,87)(H,88,89)(H,90,91)(H,106,107)/t18-,19-,20-,21-,22-,23-,24+,25+,26+,27+,28+,29+,30+,31+,37+,38+,39+,40+,41+,42+,43+/m1/s1
InChiKey：	InChIKey=RLHCLRTVFVCKIA-JOJCIWAFSA-N

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