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

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 7,8-Dihydrovomifoliol 9-[rhamnosyl-(1->6)-glucoside]
ChEBI ID CHEBI:168825
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information No supplier information found for this compound.
Download Molfile XML SDF
Formula C25H42O12
Net Charge 0
Average Mass 534.599
Monoisotopic Mass 534.26763
InChI InChI=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
InChIKey JDTFCGGOAXAFRS-UHFFFAOYSA-N
SMILES OC1(C(CC(=O)C=C1C)(C)C)CCC(OC2OC(C(O)C(O)C2O)COC3OC(C(O)C(O)C3O)C)C
Metabolite of Species Details
Malus domestica (NCBI:txid3750) Found in exocarp (BTO:0000733). of strain Malus x domestica Borkh. cv. Ruixue See: MetaboLights Study
ChEBI Ontology
Outgoing 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 Xref Database
HMDB0029770 HMDB
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