CHEBI:214849 - Phomoterpene A

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Phomoterpene A
ChEBI ID CHEBI:214849
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C15H20O4
Net Charge 0
Average Mass 264.321
Monoisotopic Mass 264.13616
InChI InChI=1S/C15H20O4/c1-9(2)4-7-13(16)10(3)12-6-5-11(15(18)19)8-14(12)17/h5-6,8-10,17H,4,7H2,1-3H3,(H,18,19)/t10-/m0/s1
InChIKey PRUVZOZQLFFFRK-JTQLQIEISA-N
SMILES O=C(O)C1=CC(O)=C([C@@H](C(=O)CCC(C)C)C)C=C1
Metabolite of Species Details
Phomopsis prunorum (NCBI:txid1932323) See: DOI
ChEBI Ontology
Outgoing Phomoterpene A (CHEBI:214849) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name
3-hydroxy-4-[(2S)-6-methyl-3-oxoheptan-2-yl]benzoic acid