CHEBI:197975 - 2,3-dihydroxy-N-benzoylserine dimer

ChEBI IDCHEBI:197975
ChEBI Name2,3-dihydroxy-N-benzoylserine dimer
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H20N2O11
Net Charge0
Average Mass464.383
Monoisotopic Mass464.10671
SMILESO=C(N[C@@H](COC(=O)[C@H](CO)NC(=O)c1cccc(O)c1O)C(=O)O)c1cccc(O)c1O
InChIInChI=1S/C20H20N2O11/c23-7-11(21-17(28)9-3-1-5-13(24)15(9)26)20(32)33-8-12(19(30)31)22-18(29)10-4-2-6-14(25)16(10)27/h1-6,11-12,23-27H,7-8H2,(H,21,28)(H,22,29)(H,30,31)/t11-,12-/m0/s1
InChIKeyKLXJDVFEFZPIMN-RYUDHWBXSA-N
Species of MetaboliteComponentSourceComments
Streptomycesspecies (ncbitaxon:1931) - PubMed (11267771)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
2,3-dihydroxy-N-benzoylserine dimer (CHEBI:197975) has functional parent N-benzoylglycine (CHEBI:18089)
2,3-dihydroxy-N-benzoylserine dimer (CHEBI:197975) is a N-acylglycine (CHEBI:16180)
IUPAC Name 
(2S)-2-[(2,3-dihydroxybenzoyl)amino]-3-[(2S)-2-[(2,3-dihydroxybenzoyl)amino]-3-hydroxypropanoyl]oxypropanoic acid
Manual XrefsDatabases
EHSPDBeChem
18534383ChemSpider