CHEBI:168601 - (1R,3S,4S,6R)-6,9-Dihydroxyfenchone 6-O-b-D-glucoside

ChEBI IDCHEBI:168601
ChEBI Name(1R,3S,4S,6R)-6,9-Dihydroxyfenchone 6-O-b-D-glucoside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H26O8
Net Charge0
Average Mass346.376
Monoisotopic Mass346.16277
SMILESCC1(CO)C(=O)C2(C)CC1CC2OC1OC(CO)C(O)C(O)C1O
InChIInChI=1S/C16H26O8/c1-15-4-7(16(2,6-18)14(15)22)3-9(15)24-13-12(21)11(20)10(19)8(5-17)23-13/h7-13,17-21H,3-6H2,1-2H3
InChIKeyQZAWDTYMSDWVFW-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)
(1R,3S,4S,6R)-6,9-Dihydroxyfenchone 6-O-b-D-glucoside (CHEBI:168601) is a terpene glycoside (CHEBI:61777)
IUPAC Name 
3-(hydroxymethyl)-1,3-dimethyl-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybicyclo[2.2.1]heptan-2-one
Manual XrefsDatabases
HMDB0033222HMDB