HER2/NEU (869-877)_Chemical Cloud Database

HER2/NEU (869-877)

Basic Information
Product Name：	HER2/NEU (869-877)
English Synonyms：	LEU-LEU-ASP-ILE-ASP-GLU-THR-GLU-TYR ; HER2/NEU (869-877)
MDL Number.：	MFCD09842092
H bond acceptor：	29
H bond donor：	16
Smile：	CC[C@H](C)[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccc(cc1)O)C(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)N
InChi：	InChI=1S/C49H75N9O20/c1-8-24(6)39(57-46(74)33(21-38(67)68)54-44(72)31(18-23(4)5)53-41(69)28(50)17-22(2)3)47(75)55-32(20-37(65)66)45(73)51-30(14-16-36(63)64)43(71)58-40(25(7)59)48(76)52-29(13-15-35(61)62)42(70)56-34(49(77)78)19-26-9-11-27(60)12-10-26/h9-12,22-25,28-34,39-40,59-60H,8,13-21,50H2,1-7H3,(H,51,73)(H,52,76)(H,53,69)(H,54,72)(H,55,75)(H,56,70)(H,57,74)(H,58,71)(H,61,62)(H,63,64)(H,65,66)(H,67,68)(H,77,78)/t24-,25+,28-,29-,30-,31-,32-,33-,34-,39-,40-/m0/s1
InChiKey：	InChIKey=LOIMPJMQMOSVHI-QDKODAGPSA-N

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