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CHEBI:205851 - Phomone B

ChEBI IDCHEBI:205851
ChEBI NamePhomone B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC15H18O6
Net Charge0
Average Mass294.303
Monoisotopic Mass294.11034
SMILESCc1c(O)cc2c(c1O)C(=O)O[C@]2(C)C(=O)[C@H](C)[C@H](C)O
InChIInChI=1S/C15H18O6/c1-6(8(3)16)13(19)15(4)9-5-10(17)7(2)12(18)11(9)14(20)21-15/h5-6,8,16-18H,1-4H3/t6-,8+,15+/m1/s1
InChIKeyWBSLDZNJMQPWTN-QUVQZYKMSA-N
Species of MetaboliteComponentSourceComments
Phomaspecies (ncbitaxon:1707701) - PubMed (31120358)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Phomone B (CHEBI:205851) is a hydroxybenzoic acid (CHEBI:24676)
IUPAC Name 
(3S)-5,7-dihydroxy-3-[(2R,3S)-3-hydroxy-2-methylbutanoyl]-3,6-dimethyl-2-benzouran-1-one