CHEBI:202372 - Arundinone B

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ChEBI Name Arundinone B
ChEBI ID CHEBI:202372
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C22H22O12
Net Charge 0
Average Mass 478.406
Monoisotopic Mass 478.11113
InChI InChI=1S/C22H22O12/c1-21(27)19(25)9-13(33-21)7(11(23)17(31-5)15(9)29-3)8-12(24)18(32-6)16(30-4)10-14(8)34-22(2,28)20(10)26/h23-24,27-28H,1-6H3
InChIKey GYLZUKZHWRRURG-UHFFFAOYSA-N
SMILES O=C1C2=C(OC)C(OC)=C(O)C(=C2OC1(O)C)C3=C(O)C(OC)=C(OC)C4=C3OC(O)(C)C4=O
Metabolite of Species Details
Microsphaeropsis arundinis (NCBI:txid413604) See: PubMed
Roles Classification
Application(s): astringent
A compound that causes the contraction of body tissues, typically used to reduce bleeding from minor abrasions.
(via tannin )
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ChEBI Ontology
Outgoing Arundinone B (CHEBI:202372) is a tannin (CHEBI:26848)
IUPAC Name
7-(2,6-dihydroxy-4,5-dimethoxy-2-methyl-3-oxo-1-benzouran-7-yl)-2,6-dihydroxy-4,5-dimethoxy-2-methyl-1-benzouran-3-one
Manual Xref Database
29419125 ChemSpider
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