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CHEBI:204010 - Circumcin B

ChEBI IDCHEBI:204010
ChEBI NameCircumcin B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H16O4
Net Charge0
Average Mass272.300
Monoisotopic Mass272.10486
SMILESO=C(Cc1ccc(O)cc1)[C@@H](O)Cc1ccc(O)cc1
InChIInChI=1S/C16H16O4/c17-13-5-1-11(2-6-13)9-15(19)16(20)10-12-3-7-14(18)8-4-12/h1-8,15,17-19H,9-10H2/t15-/m0/s1
InChIKeyGHFNRZWUUPDAKZ-HNNXBMFYSA-N
Species of MetaboliteComponentSourceComments
Gordoniaspecies 647W.R.1a.05 (ncbitaxon:1331488) - PubMed (23880542)
ChEBI Ontology
Outgoing Relation(s)
Circumcin B (CHEBI:204010) is a phenylpropanoid (CHEBI:26004)
IUPAC Name 
3-hydroxy-1,4-bis(4-hydroxyphenyl)butan-2-one
Manual XrefsDatabases
30824689ChemSpider