1,2-Anhydridoniveusin (CHEBI:175827)

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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	1,2-Anhydridoniveusin

ChEBI ID	CHEBI:175827

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C20H24O7

Net Charge

Average Mass

376.405

Monoisotopic Mass

376.15220

InChI

InChI=1S/C20H24O7/c1-5-11(2)17(22)26-15-9-19(4)6-7-20(24,27-19)13(10-21)8-14-16(15)12(3)18(23)25-14/h5-8,14-16,21,24H,3,9-10H2,1-2,4H3/b11-5+,13-8+

InChIKey

ZXQIVEHVNKQIIU-PZLJUMJASA-N

SMILES

O1C2(CC(OC(=O)/C(/C)=C/C)C3C(OC(=O)C3=C)C=C(C1(O)C=C2)CO)C

ChEBI Ontology
Outgoing	1,2-Anhydridoniveusin (CHEBI:175827) is a fatty acid ester (CHEBI:35748)

IUPAC Name

[(2E)-1-hydroxy-2-(hydroxymethyl)-11-methyl-7-methylidene-6-oxo-5,14-dioxatricyclo[9.2.1.04,8]tetradeca-2,12-dien-9-yl] (E)-2-methylbut-2-enoate