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CHEBI:206679 - Vaccinol P

ChEBI IDCHEBI:206679
ChEBI NameVaccinol P
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H24O5
Net Charge0
Average Mass308.374
Monoisotopic Mass308.16237
SMILESC/C(=C\Cc1ccc(O)c2c1[C@@H](C[C@@H](O)[C@H](C)O)OC2)CO
InChIInChI=1S/C17H24O5/c1-10(8-18)3-4-12-5-6-14(20)13-9-22-16(17(12)13)7-15(21)11(2)19/h3,5-6,11,15-16,18-21H,4,7-9H2,1-2H3/b10-3+/t11-,15+,16+/m0/s1
InChIKeyYQUYMSREFQCZEC-HMWHCXLWSA-N
Species of MetaboliteComponentSourceComments
Pestalotiopsis (ncbitaxon:37840) - PubMed (28625729)
ChEBI Ontology
Outgoing Relation(s)
Vaccinol P (CHEBI:206679) is a 2-benzofurans (CHEBI:38831)
IUPAC Name 
(2R,3S)-1-[(1R)-4-hydroxy-7-[(E)-4-hydroxy-3-methylbut-2-enyl]-1,3-dihydro-2-benzouran-1-yl]butane-2,3-diol
Manual XrefsDatabases
62285131ChemSpider