CHEBI:174630 - Anomurine

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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 Anomurine
ChEBI ID CHEBI:174630
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C20H25NO4
Net Charge 0
Average Mass 343.423
Monoisotopic Mass 343.17836
InChI InChI=1S/C20H25NO4/c1-22-14-7-5-13(6-8-14)11-17-16-12-18(23-2)20(25-4)19(24-3)15(16)9-10-21-17/h5-8,12,17,21H,9-11H2,1-4H3
InChIKey CMQSBRRTRZPLHE-UHFFFAOYSA-N
SMILES O(C1=C2C(C(NCC2)CC3=CC=C(OC)C=C3)=CC(OC)=C1OC)C
ChEBI Ontology
Outgoing Anomurine (CHEBI:174630) is a isoquinolines (CHEBI:24922)
IUPAC Name
5,6,7-trimethoxy-1-[(4-methoxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline
Manual Xrefs Databases
138367 ChemSpider
HMDB0030270 HMDB
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Registry Number Type Source
78478-27-0 CAS Registry Number ChemIDplus