CHEBI:174974 - Annocherine B

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ChEBI Name Annocherine B
ChEBI ID CHEBI:174974
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C18H17NO4
Net Charge 0
Average Mass 311.337
Monoisotopic Mass 311.11576
InChI InChI=1S/C18H17NO4/c1-22-16-9-12-7-8-19-17(14(12)10-15(16)21)18(23-2)11-3-5-13(20)6-4-11/h3-10,18,20-21H,1-2H3/t18-/m0/s1
InChIKey UGPTYMLHEHFVJS-SFHVURJKSA-N
SMILES O([C@H](C1=NC=CC=2C1=CC(O)=C(OC)C2)C3=CC=C(O)C=C3)C
ChEBI Ontology
Outgoing Annocherine B (CHEBI:174974) is a isoquinolines (CHEBI:24922)
IUPAC Name
1-[(S)-(4-hydroxyphenyl)-methoxymethyl]-6-methoxyisoquinolin-7-ol
Manual Xref Database
4477486 ChemSpider
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