(Z-ILE-GLU-THR-ASP)-R110_Chemical Cloud Database

(Z-ILE-GLU-THR-ASP)-R110

Basic Information
Product Name：	(Z-ILE-GLU-THR-ASP)-R110
English Synonyms：	(Z-ILE-GLU-THR-ASP)-R110 ; Z-IETD-R110
MDL Number.：	MFCD03428409
H bond acceptor：	35
H bond donor：	17
Smile：	CC[C@@H](C)[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(=O)O)C(=O)Nc1ccc2c(c1)[o+]c3cc(ccc3c2c4ccccc4C(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]([C@H](C)CC)NC(=O)OCc5ccccc5)NC(=O)OCc6ccccc6.[Cl-]
InChi：	InChI=1S/C74H86N10O25.ClH/c1-7-37(3)60(83-73(105)107-35-41-17-11-9-12-18-41)68(99)77-49(27-29-55(87)88)64(95)81-62(39(5)85)70(101)79-51(33-57(91)92)66(97)75-43-23-25-47-53(31-43)109-54-32-44(24-26-48(54)59(47)45-21-15-16-22-46(45)72(103)104)76-67(98)52(34-58(93)94)80-71(102)63(40(6)86)82-65(96)50(28-30-56(89)90)78-69(100)61(38(4)8-2)84-74(106)108-36-42-19-13-10-14-20-42;/h9-26,31-32,37-40,49-52,60-63,85-86H,7-8,27-30,33-36H2,1-6H3,(H14-,75,76,77,78,79,80,81,82,83,84,87,88,89,90,91,92,93,94,95,96,97,98,99,100,101,102,103,104,105,106);1H/t37-,38-,39-,40-,49+,50+,51+,52+,60-,61-,62+,63+;/m1./s1
InChiKey：	InChIKey=YHQXRBVBEKIOCU-WEXNRDQCSA-N

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