CHEBI:181046 - 8-benzoyl-2-[(Z)-1,2-dihydroxyhex-3-enyl]-9-hydroxy-8-methoxy-3-methyl-1-oxa-7-azaspiro[4.4]non-2-ene-4,6-dione

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ChEBI Name 8-benzoyl-2-[(Z)-1,2-dihydroxyhex-3-enyl]-9-hydroxy-8-methoxy-3-methyl-1-oxa-7-azaspiro[4.4]non-2-ene-4,6-dione
ChEBI ID CHEBI:181046
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C22H25NO8
Net Charge 0
Average Mass 431.441
Monoisotopic Mass 431.15802
InChI InChI=1S/C22H25NO8/c1-4-5-11-14(24)15(25)16-12(2)17(26)21(31-16)19(28)22(30-3,23-20(21)29)18(27)13-9-7-6-8-10-13/h5-11,14-15,19,24-25,28H,4H2,1-3H3,(H,23,29)/b11-5-
InChIKey SLYDIPAXCVVRNY-WZUFQYTHSA-N
SMILES O1C2(C(O)C(OC)(NC2=O)C(=O)C3=CC=CC=C3)C(=O)C(=C1C(O)C(O)/C=C\CC)C
ChEBI Ontology
Outgoing 8-benzoyl-2-[(Z)-1,2-dihydroxyhex-3-enyl]-9-hydroxy-8-methoxy-3-methyl-1-oxa-7-azaspiro[4.4]non-2-ene-4,6-dione (CHEBI:181046) is a aromatic ketone (CHEBI:76224)
IUPAC Name
8-benzoyl-2-[(Z)-1,2-dihydroxyhex-3-enyl]-9-hydroxy-8-methoxy-3-methyl-1-oxa-7-azaspiro[4.4]non-2-ene-4,6-dione
Manual Xref Database
4713650 ChemSpider
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