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CHEBI:209377 - Chaetophenol G

ChEBI IDCHEBI:209377
ChEBI NameChaetophenol G
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SubmitterMetaboLights
DownloadsMolfile
FormulaC19H22O7
Net Charge0
Average Mass362.378
Monoisotopic Mass362.13655
SMILESCC(C)=CCc1c(O)c(C)c(O)c2c1[C@@H]([C@@]1(C)C[C@@H](O)C(=O)O1)OC2=O
InChIInChI=1S/C19H22O7/c1-8(2)5-6-10-12-13(15(22)9(3)14(10)21)18(24)25-16(12)19(4)7-11(20)17(23)26-19/h5,11,16,20-22H,6-7H2,1-4H3/t11-,16+,19-/m1/s1
InChIKeyYZBQWOKLCWGSMK-XNPNBVRTSA-N
Species of MetaboliteComponentSourceComments
Chaetomium cancroideum (ncbitaxon:874300) - PubMed (26549741)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Chaetophenol G (CHEBI:209377) is a hydroxybenzoic acid (CHEBI:24676)
IUPAC Name 
(3S)-5,7-dihydroxy-3-[(2R,4R)-4-hydroxy-2-methyl-5-oxooxolan-2-yl]-6-methyl-4-(3-methylbut-2-enyl)-3H-2-benzouran-1-one
Manual XrefsDatabases
78437934ChemSpider