CHEBI:188087 - SERICETIN DIACETATE

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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 SERICETIN DIACETATE
ChEBI ID CHEBI:188087
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C29H28O7
Net Charge 0
Average Mass 488.536
Monoisotopic Mass 488.18350
InChI InChI=1S/C29H28O7/c1-16(2)12-13-20-25-21(14-15-29(5,6)36-25)26(33-17(3)30)22-23(32)28(34-18(4)31)24(35-27(20)22)19-10-8-7-9-11-19/h7-12,14-15H,13H2,1-6H3
InChIKey IIKLIRVROMFZGV-UHFFFAOYSA-N
SMILES O1C(C=CC2=C1C(=C3OC(=C(OC(=O)C)C(=O)C3=C2OC(=O)C)C4=CC=CC=C4)CC=C(C)C)(C)C
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in blood plasma (BTO:0000131). See: MetaboLights Study
ChEBI Ontology
Outgoing SERICETIN DIACETATE (CHEBI:188087) is a flavones (CHEBI:24043)
IUPAC Name
[7-acetyloxy-2,2-dimethyl-10-(3-methylbut-2-enyl)-6-oxo-8-phenylpyrano[3,2-g]chromen-5-yl] acetate
Manual Xref Database
3767731 ChemSpider
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