CHEBI:169192 - (S)-Annocherine A

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ChEBI Name (S)-Annocherine A
ChEBI ID CHEBI:169192
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C17H15NO4
Net Charge 0
Average Mass 297.310
Monoisotopic Mass 297.10011
InChI InChI=1S/C17H15NO4/c1-22-15-8-11-6-7-18-16(13(11)9-14(15)20)17(21)10-2-4-12(19)5-3-10/h2-9,17,19-21H,1H3
InChIKey XWZBLZPLPZOXQV-UHFFFAOYSA-N
SMILES OC(C1=NC=CC=2C1=CC(O)=C(OC)C2)C3=CC=C(O)C=C3
Metabolite of Species Details
Malus domestica (NCBI:txid3750) Found in exocarp (BTO:0000733). of strain Malus x domestica Borkh. cv. Ruixue See: MetaboLights Study
ChEBI Ontology
Outgoing (S)-Annocherine A (CHEBI:169192) is a isoquinolines (CHEBI:24922)
IUPAC Name
1-[hydroxy-(4-hydroxyphenyl)methyl]-6-methoxyisoquinolin-7-ol
Manual Xrefs Databases
20057386 ChemSpider
HMDB0038723 HMDB
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