(1S,4R)-10-Hydroxyfenchone glucoside (CHEBI:168123)

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	(1S,4R)-10-Hydroxyfenchone glucoside

ChEBI ID	CHEBI:168123

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C16H26O7

Net Charge

Average Mass

330.377

Monoisotopic Mass

330.16785

InChI

InChI=1S/C16H26O7/c1-15(2)8-3-4-16(5-8,14(15)21)7-22-13-12(20)11(19)10(18)9(6-17)23-13/h8-13,17-20H,3-7H2,1-2H3

InChIKey

WERYFGDRRGZFRG-UHFFFAOYSA-N

SMILES

O(CC12CC(C(C1=O)(C)C)CC2)C3OC(C(O)C(O)C3O)CO

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	(1S,4R)-10-Hydroxyfenchone glucoside (CHEBI:168123) is a terpene glycoside (CHEBI:61777)

IUPAC Name

3,3-dimethyl-1-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]bicyclo[2.2.1]heptan-2-one