Summary

IMPPAT Phytochemical identifier: IMPHY003022

Phytochemical name: Cysteic Acid

Synonymous chemical names:
cysteic acid

External chemical identifiers:
CID:25701, ChEMBL:CHEMBL1171434, ChEBI:21260, FDASRS:A3OGP4C37W, SureChEMBL:SCHEMBL44030, MolPort-000-002-652

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Chemical structure information

SMILES:
OC(=O)C(CS(=O)(=O)O)N

InChI:
InChI=1S/C3H7NO5S/c4-2(3(5)6)1-10(7,8)9/h2H,1,4H2,(H,5,6)(H,7,8,9)

InChIKey:
XVOYSCVBGLVSOL-UHFFFAOYSA-N

DeepSMILES:
OC=O)CCS=O)=O)O)))N

Functional groups:
CC(=O)O, CN, CS(=O)(=O)O

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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: 0.34

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Chemical structure download