EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:140484 - angl#2

Default Structure
ChEBI IDCHEBI:140484
ChEBI Nameangl#2
Stars
SubmitterMichael Witting
DownloadsMolfile
FormulaC13H18NO10P
Net Charge0
Average Mass379.258
Monoisotopic Mass379.06683
SMILESNc1ccccc1C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](OP(=O)(O)O)[C@H]1O
InChIInChI=1S/C13H18NO10P/c14-7-4-2-1-3-6(7)12(18)23-13-10(17)11(24-25(19,20)21)9(16)8(5-15)22-13/h1-4,8-11,13,15-17H,5,14H2,(H2,19,20,21)/t8-,9-,10-,11+,13?/m1/s1
InChIKeyMVVUNNGPSNCMMK-LWYAWAMPSA-N
Species of MetaboliteComponentSourceComments
Caenorhabditis elegans (ncbitaxon:6239) - Article (http://journals.plos.org/plosbiology/article?id=10.1371/journal.pbio.1001613)
ChEBI Ontology
Outgoing Relation(s)
angl#2 (CHEBI:140484) is a organic molecular entity (CHEBI:50860)