6-(1,2-Dihydroxy-5,6-diacetoxy-3-heptenyl)-5,6-dihydro-2H-pyran-2-one (CHEBI:182672)

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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	6-(1,2-Dihydroxy-5,6-diacetoxy-3-heptenyl)-5,6-dihydro-2H-pyran-2-one

ChEBI ID	CHEBI:182672

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C16H22O8

Net Charge

Average Mass

342.344

Monoisotopic Mass

342.13147

InChI

InChI=1S/C16H22O8/c1-9(22-10(2)17)13(23-11(3)18)8-7-12(19)16(21)14-5-4-6-15(20)24-14/h4,6-9,12-14,16,19,21H,5H2,1-3H3/b8-7+

InChIKey

RAZHULSADOGMPF-BQYQJAHWSA-N

SMILES

O1C(C(O)C(O)/C=C/C(OC(=O)C)C(OC(=O)C)C)CC=CC1=O

ChEBI Ontology
Outgoing	6-(1,2-Dihydroxy-5,6-diacetoxy-3-heptenyl)-5,6-dihydro-2H-pyran-2-one (CHEBI:182672) is a carbonyl compound (CHEBI:36586)

IUPAC Name

[(E)-3-acetyloxy-6,7-dihydroxy-7-(6-oxo-2,3-dihydropyran-2-yl)hept-4-en-2-yl] acetate