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CHEBI:230017 - Ggstop

ChEBI IDCHEBI:230017
ChEBI NameGgstop
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H18NO7P
Net Charge0
Average Mass331.261
Monoisotopic Mass331.08209
SMILESCOP(=O)(CCC(N)C(=O)O)Oc1cccc(CC(=O)O)c1
InChIInChI=1S/C13H18NO7P/c1-20-22(19,6-5-11(14)13(17)18)21-10-4-2-3-9(7-10)8-12(15)16/h2-4,7,11H,5-6,8,14H2,1H3,(H,15,16)(H,17,18)
InChIKeyNTFPDEDRMYYPAC-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS9100)
Roles Classification
Chemical Roles:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Ggstop (CHEBI:230017) is a α-amino acid (CHEBI:33704)
IUPAC Name 
2-amino-4-[[3-(carboxymethyl)phenoxy]-methoxyphosphoryl]butanoic acid
Manual XrefsDatabases
30774259ChemSpider
HMDB0252708HMDB