CHEBI:168436 - chondroitin sulfate E (GalNAc4,6diS-GlcA), precursor 5a

ChEBI IDCHEBI:168436
ChEBI Namechondroitin sulfate E (GalNAc4,6diS-GlcA), precursor 5a
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC7H9N3O
Net Charge0
Average Mass151.169
Monoisotopic Mass151.07456
SMILESNNC(=O)Nc1ccccc1
InChIInChI=1S/C7H9N3O/c8-10-7(11)9-6-4-2-1-3-5-6/h1-5H,8H2,(H2,9,10,11)
InChIKeyMOCKWYUCPREFCZ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
ChEBI Ontology
Outgoing Relation(s)
chondroitin sulfate E (GalNAc4,6diS-GlcA), precursor 5a (CHEBI:168436) is a ureas (CHEBI:47857)
IUPAC Name 
1-amino-3-phenylurea
Manual XrefsDatabases
10380ChemSpider
HMDB0062464HMDB
Registry NumbersSources
CAS:537-47-3ChemIDplus