EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:207883 - Phaseolorin B

ChEBI IDCHEBI:207883
ChEBI NamePhaseolorin B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H16O7
Net Charge0
Average Mass308.286
Monoisotopic Mass308.08960
SMILESO=C1C[C@@H]([C@H](O)[C@@]2(CO)CC(=O)c3c(O)cccc3O2)CO1
InChIInChI=1S/C15H16O7/c16-7-15(14(20)8-4-12(19)21-6-8)5-10(18)13-9(17)2-1-3-11(13)22-15/h1-3,8,14,16-17,20H,4-7H2/t8-,14+,15+/m1/s1
InChIKeyDKZBSBHPZOTUCG-YIUPMNOESA-N
Species of MetaboliteComponentSourceComments
Diaporthe (ncbitaxon:36922) - PubMed (30897716)
ChEBI Ontology
Outgoing Relation(s)
Phaseolorin B (CHEBI:207883) is a chromones (CHEBI:23238)
IUPAC Name 
(2S)-5-hydroxy-2-(hydroxymethyl)-2-[(S)-hydroxy-[(3R)-5-oxooxolan-3-yl]methyl]-3H-chromen-4-one
Manual XrefsDatabases
73930377ChemSpider