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Dehydrohistidyltryptophyldiketopiperazine

MNXM148200 is deprecated and replaced by MNXM1100738

Properties

Image

Occurences in reactions

MNX_ID

MNXM1100738

	#reac
in my sandbox	0
in MNXref (generic)	4
in models (compartimentalized)	0

formula

C₁₇H₁₅N₅O₂

charge

mass

321.12257

reference

keggC:C22164

InChIKey

ITXQTTPWGBFRNK-GIDUJCDVSA-N

InChI

InChI=1S/C17H15N5O2/c23-16-14(5-10-7-19-13-4-2-1-3-12(10)13)21-17(24)15(22-16)6-11-8-18-9-20-11/h1-4,6-9,14,19H,5H2,(H,18,20)(H,21,24)(H,22,23)/b15-6+

SMILES

O=C1NC(Cc2c[nH]c3ccccc23)C(=O)N/C1=C/c1c[nH]cn1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
kegg.compound:C22164 keggC:C22164	Dehydrohistidyltryptophyldiketopiperazine
seed.compound:cpd34180 seedM:cpd34180	DHTD dehydrohistidyltryptophyldiketopiperazine
metacyc.compound:CPD-17379 metacycM:CPD-17379	dehydrohistidyltryptophyldiketopiperazine DHTD
keggC:M_C22164 seedM:M_cpd34180	secondary/obsolete/fantasy identifier