SIVMAC239-28_化学云数据库

SIVMAC239-28

基本信息
产品名称：	SIVMAC239-28
英文同义词：	H-VAL-VAL-GLU-THR-GLY-THR-THR-GLU-THR-MET-PRO-LYS-THR-SER-ARG-OH ; SIVMAC239-28 ; V VETGTTETMPKTSR
MDL号：	MFCD03790675
氢键受体数量：	45
氢键供体数量：	27
Smile：	CC(C)[C@@H](C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H]([C@@H](C)O)C(=O)NCC(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CCSC)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)N
InChi：	InChI=1S/C67H117N19O26S/c1-29(2)46(69)58(103)81-47(30(3)4)60(105)75-37(18-20-44(94)95)54(99)82-48(31(5)88)59(104)73-27-43(93)80-49(32(6)89)64(109)85-52(35(9)92)61(106)76-38(19-21-45(96)97)55(100)84-50(33(7)90)62(107)77-39(22-26-113-10)65(110)86-25-14-17-42(86)57(102)74-36(15-11-12-23-68)53(98)83-51(34(8)91)63(108)79-41(28-87)56(101)78-40(66(111)112)16-13-24-72-67(70)71/h29-42,46-52,87-92H,11-28,68-69H2,1-10H3,(H,73,104)(H,74,102)(H,75,105)(H,76,106)(H,77,107)(H,78,101)(H,79,108)(H,80,93)(H,81,103)(H,82,99)(H,83,98)(H,84,100)(H,85,109)(H,94,95)(H,96,97)(H,111,112)(H4,70,71,72)/t31-,32-,33-,34-,35-,36+,37+,38+,39+,40+,41+,42+,46+,47+,48+,49+,50+,51+,52+/m1/s1
InChiKey：	InChIKey=GXWOHTIGBHYIPX-PHNBQECNSA-N

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