Summary

IMPPAT Phytochemical identifier: IMPHY009529

Phytochemical name: N-(3-Carboxy-2,3-dihydroxypropyl)-4-((carboxymethyl)amino)threonine

Synonymous chemical names:
distichonic acid a

External chemical identifiers:
CID:134774

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Chemical structure information

SMILES:
OC(=O)CNC[C@H]([C@@H](C(=O)O)NCC(C(C(=O)O)O)O)O

InChI:
InChI=1S/C10H18N2O9/c13-4(1-11-3-6(15)16)7(9(18)19)12-2-5(14)8(17)10(20)21/h4-5,7-8,11-14,17H,1-3H2,(H,15,16)(H,18,19)(H,20,21)/t4-,5?,7+,8?/m1/s1

InChIKey:
MTSCMKDFRXDNNA-RCAXORGESA-N

DeepSMILES:
OC=O)CNC[C@H][C@@H]C=O)O))NCCCC=O)O))O))O)))))O

Functional groups:
CC(=O)O, CNC, CO

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organic acids and derivatives

ClassyFire Class: Carboxylic acids and derivatives

ClassyFire Subclass: Amino acids, peptides, and analogues

NP Classifier Biosynthetic pathway: Amino acids and Peptides

NP Classifier Superclass: Small peptides

NP Classifier Class: Aminoacids

NP-Likeness score: 0.431

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Chemical structure download