CHEBI:226450 - Ilyoresorcy H

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ChEBI Name Ilyoresorcy H
ChEBI ID CHEBI:226450
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C18H20O7
Net Charge 0
Average Mass 348.351
Monoisotopic Mass 348.12090
InChI InChI=1S/C18H20O7/c1-9-4-14(21)16-3-2-13(25-16)7-11(19)5-10-6-12(20)8-15(22)17(10)18(23)24-9/h2-3,6,8-9,13-14,16,20-22H,4-5,7H2,1H3/t9-,13-,14-,16+/m1/s1
InChIKey MVNKZJOHLPIVIG-OLUKKTBOSA-N
SMILES O=C1O[C@@H](C[C@@H](O)[C@H]2O[C@@H](CC(CC=3C1=C(O)C=C(O)C3)=O)C=C2)C
Metabolite of Species Details
Ilyonectria (NCBI:txid1079112) See: PubMed
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Ilyoresorcy H (CHEBI:226450) is a hydroxybenzoic acid (CHEBI:24676)
IUPAC Name
(1S,13R,15R,16S)-7,9,15-trihydroxy-13-methyl-12,19-dioxatricyclo[14.2.1.05,10]nonadeca-5(10),6,8,17-tetraene-3,11-dione