CHEBI:6389 - Laudanosine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Laudanosine
ChEBI ID CHEBI:6389
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C21H27NO4
Net Charge 0
Average Mass 357.444
Monoisotopic Mass 357.19401
InChI InChI=1S/C21H27NO4/c1-22-9-8-15-12-20(25-4)21(26-5)13-16(15)17(22)10-14-6-7-18(23-2)19(11-14)24-3/h6-7,11-13,17H,8-10H2,1-5H3/t17-/m0/s1
InChIKey KGPAYJZAMGEDIQ-KRWDZBQOSA-N
SMILES COc1ccc(C[C@@H]2N(C)CCc3cc(OC)c(OC)cc23)cc1OC
ChEBI Ontology
Outgoing Laudanosine (CHEBI:6389) is a isoquinolines (CHEBI:24922)
Laudanosine (CHEBI:6389) is conjugate base of (S)-laudanosine(1+) (CHEBI:195218)
Incoming (S)-laudanosine(1+) (CHEBI:195218) is conjugate acid of Laudanosine (CHEBI:6389)
Synonym Source
Laudanosine KEGG COMPOUND
Manual Xrefs Databases
C00001876 KNApSAcK
C00028454 KNApSAcK
C09558 KEGG COMPOUND
View more database links
Registry Number Type Source
2688-77-9 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014