CHEBI:188859 - Cyclohexane-1,2-diaminetetraacetic acid

ChEBI IDCHEBI:188859
ChEBI NameCyclohexane-1,2-diaminetetraacetic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H22N2O8
Net Charge0
Average Mass346.336
Monoisotopic Mass346.13762
SMILESO=C(O)CN(CC(=O)O)C1CCCCC1N(CC(=O)O)CC(=O)O
InChIInChI=1S/C14H22N2O8/c17-11(18)5-15(6-12(19)20)9-3-1-2-4-10(9)16(7-13(21)22)8-14(23)24/h9-10H,1-8H2,(H,17,18)(H,19,20)(H,21,22)(H,23,24)
InChIKeyFCKYPQBAHLOOJQ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Phyllostachys violascens (ncbitaxon:1903417) stem (BTO:0001300) MetaboLights (MTBLS3970) Strain: Phyllostachys violascens cv. Viridisulcata
ChEBI Ontology
Outgoing Relation(s)
Cyclohexane-1,2-diaminetetraacetic acid (CHEBI:188859) has functional parent tetracarboxylic acid (CHEBI:35742)
Cyclohexane-1,2-diaminetetraacetic acid (CHEBI:188859) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
2-[[2-[bis(carboxymethyl)amino]cyclohexyl]-(carboxymethyl)amino]acetic acid
Manual XrefsDatabases
9798ChemSpider
Registry NumbersSources
CAS:482-54-2ChemIDplus