N-(3-{[(N-{2-[(alpha-Glu-Leu-Ala)NH]ethyl}-Trp)amino]methyl}benzoyl)-Leu-Thr-Val

Properties MNX_ID MNXM63193 formula C50H74N10O12 charge 0 mass 1007.1824 reference chebi:63870

InChIKey	LUCXYJNVXGTVDX-HMLAGTQQSA-N
InChI	InChI=1S/C50H74N10O12/c1-26(2)20-38(58-45(66)35(51)16-17-40(62)63)47(68)56-29(7)43(64)53-19-18-52-37(23-33-25-54-36-15-10-9-14-34(33)36)46(67)55-24-31-12-11-13-32(22-31)44(65)57-39(21-27(3)4)48(69)60-42(30(8)61)49(70)59-41(28(5)6)50(71)72/h9-15,22,25-30,35,37-39,41-42,52,54,61H,16-21,23-24,51H2,1-8H3,(H,53,64)(H,55,67)(H,56,68)(H,57,65)(H,58,66)(H,59,70)(H,60,69)(H,62,63)(H,71,72)/t29-,30+,35-,37-,38-,39-,41-,42-/m0/s1
SMILES	CC(C)C[C@H](NC(=O)[C@@H]([NH3+])CCC([O-])=O)C(=O)N[C@@H](C)C(=O)NCC[NH2+][C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cccc(c1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](C(C)C)C([O-])=O

This chemical compound does not exist in my selection

Occurrences of N-(3-{[(N-{2-[(alpha-Glu-Leu-Ala)NH]ethyl}-Trp)amino]methyl}benzoyl)-Leu-Thr-Val in the MetaNetX repository

Similar chemical compounds in external resources

Identifier	Description
chebi:63870	ELAG(PsiCH2NH)W-(3-aminomethylbenzoic acid)-LTV LUCXYJNVXGTVDX-HMLAGTQQSA-N N-(3-{[(N-{2-[(L-alpha-glutamyl-L-leucyl-L-alanyl)amino]ethyl}-L-tryptophyl)amino]methyl}benzoyl)-L-leucyl-L-threonyl-L-valine N-(3-{[(N-{2-[(alpha-Glu-Leu-Ala)NH]ethyl}-Trp)amino]methyl}benzoyl)-Leu-Thr-Val N-(3-{[(N-{2-[(alpha-glutamylleucylalanyl)amino]ethyl}tryptophyl)amino]methyl}benzoyl)leucylthreonylvaline