CHEBI:176946 - (S)-Norlaudanine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
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 (S)-Norlaudanine
ChEBI ID CHEBI:176946
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C19H23NO4
Net Charge 0
Average Mass 329.396
Monoisotopic Mass 329.16271
InChI InChI=1S/C19H23NO4/c1-22-17-5-4-12(9-16(17)21)8-15-14-11-19(24-3)18(23-2)10-13(14)6-7-20-15/h4-5,9-11,15,20-21H,6-8H2,1-3H3/t15-/m0/s1
InChIKey PBARFBACJNHQIC-HNNXBMFYSA-N
SMILES O(C=1C=C2[C@@H](NCCC2=CC1OC)CC3=CC(O)=C(OC)C=C3)C
Metabolite of Species Details
Streptococcus mutans (NCBI:txid1309) Found in biofilm (BTO:0002690). of strain Streptococcus mutans UA159 [NCBI:txid210007] See: MetaboLights Study
ChEBI Ontology
Outgoing (S)-Norlaudanine (CHEBI:176946) is a isoquinolines (CHEBI:24922)
IUPAC Name
5-[[(1S)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl]-2-methoxyphenol
Manual Xrefs Databases
5412327 ChemSpider
C21630 KEGG COMPOUND
View more database links