Lepidimoic acid (CHEBI:169657)

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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	Lepidimoic acid

ChEBI ID	CHEBI:169657

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C12H18O10

Net Charge

Average Mass

322.266

Monoisotopic Mass

322.09000

InChI

InChI=1S/C12H18O10/c1-3-6(14)8(16)9(11(19)20-3)22-12-7(15)4(13)2-5(21-12)10(17)18/h2-4,6-9,11-16,19H,1H3,(H,17,18)

InChIKey

PBUKNNGDHZLXKG-UHFFFAOYSA-N

SMILES

O1C(C(O)C(O)C(OC2OC(=CC(O)C2O)C(O)=O)C1O)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	Lepidimoic acid (CHEBI:169657) is a disaccharide (CHEBI:36233)

IUPAC Name

3,4-dihydroxy-2-(2,4,5-trihydroxy-6-methyloxan-3-yl)oxy-3,4-dihydro-2H-pyran-6-carboxylic acid