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CHEBI:168302 - 8-Hydroxy-4(6)-lactarene-5,14-diol

ChEBI IDCHEBI:168302
ChEBI Name8-Hydroxy-4(6)-lactarene-5,14-diol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H26O3
Net Charge0
Average Mass254.370
Monoisotopic Mass254.18819
SMILESCC1C=C(CO)C(CO)C(O)C2CC(C)(C)CC12
InChIInChI=1S/C15H26O3/c1-9-4-10(7-16)13(8-17)14(18)12-6-15(2,3)5-11(9)12/h4,9,11-14,16-18H,5-8H2,1-3H3
InChIKeyUMXJEXAFNWMBJX-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
ChEBI Ontology
Outgoing Relation(s)
8-Hydroxy-4(6)-lactarene-5,14-diol (CHEBI:168302) is a secondary alcohol (CHEBI:35681)
IUPAC Name 
5,6-bis(hydroxymethyl)-2,2,8-trimethyl-3,3a,4,5,8,8a-hexahydro-1H-azulen-4-ol
Manual XrefsDatabases
HMDB0035780HMDB
35014019ChemSpider