EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:210260 - Longiphthalidin A

ChEBI IDCHEBI:210260
ChEBI NameLongiphthalidin A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H12O6
Net Charge0
Average Mass252.222
Monoisotopic Mass252.06339
SMILESCC(=O)O[C@H](C)[C@@H]1OC(=O)c2c(O)cc(O)cc21
InChIInChI=1S/C12H12O6/c1-5(17-6(2)13)11-8-3-7(14)4-9(15)10(8)12(16)18-11/h3-5,11,14-15H,1-2H3/t5-,11+/m1/s1
InChIKeyIYTNAAPGIWAKSC-GCXOYZPQSA-N
Species of MetaboliteComponentSourceComments
Diaporthe (ncbitaxon:36922) - PubMed (32717916)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Longiphthalidin A (CHEBI:210260) is a hydroxybenzoic acid (CHEBI:24676)
IUPAC Name 
[(1R)-1-[(1R)-4,6-dihydroxy-3-oxo-1H-2-benzouran-1-yl]ethyl] acetate
Manual XrefsDatabases
90298206ChemSpider