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CHEBI:226956 - Aspergillusene C

ChEBI IDCHEBI:226956
ChEBI NameAspergillusene C
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SubmitterMetaboLights
DownloadsMolfile
FormulaC15H20O4
Net Charge0
Average Mass264.321
Monoisotopic Mass264.13616
SMILESC/C(=C\C[C@H](O)C(C)C)c1ccc(C(=O)O)cc1O
InChIInChI=1S/C15H20O4/c1-9(2)13(16)7-4-10(3)12-6-5-11(15(18)19)8-14(12)17/h4-6,8-9,13,16-17H,7H2,1-3H3,(H,18,19)/b10-4+/t13-/m0/s1
InChIKeyBEIIQDAJVMUPKL-CFDVYZKQSA-N
Species of MetaboliteComponentSourceComments
Aspergillus sydowii (ncbitaxon:75750) - PubMed (24736857)
ChEBI Ontology
Outgoing Relation(s)
Aspergillusene C (CHEBI:226956) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
3-hydroxy-4-[(E)-5-hydroxy-6-methylhept-2-en-2-yl]benzoic acid
Manual XrefsDatabases
34981842ChemSpider