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CHEBI:168825 - 7,8-Dihydrovomifoliol 9-[rhamnosyl-(1->6)-glucoside]

ChEBI IDCHEBI:168825
ChEBI Name7,8-Dihydrovomifoliol 9-[rhamnosyl-(1->6)-glucoside]
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC25H42O12
Net Charge0
Average Mass534.599
Monoisotopic Mass534.26763
SMILESCC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OC(C)C(O)C(O)C2O)C(O)C(O)C1O
InChIInChI=1S/C25H42O12/c1-11-8-14(26)9-24(4,5)25(11,33)7-6-12(2)35-23-21(32)19(30)17(28)15(37-23)10-34-22-20(31)18(29)16(27)13(3)36-22/h8,12-13,15-23,27-33H,6-7,9-10H2,1-5H3
InChIKeyJDTFCGGOAXAFRS-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)
7,8-Dihydrovomifoliol 9-[rhamnosyl-(1->6)-glucoside] (CHEBI:168825) is a O-acyl carbohydrate (CHEBI:52782)
IUPAC Name 
4-hydroxy-3,5,5-trimethyl-4-[3-[3,4,5-trihydroxy-6-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl]oxan-2-yl]oxybutyl]cyclohex-2-en-1-one
Manual XrefsDatabases
HMDB0029770HMDB