EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C18H21NO4 |
| Net Charge | 0 |
| Average Mass | 315.369 |
| Monoisotopic Mass | 315.14706 |
| SMILES | COc1ccc(C[C@H]2NCCc3cc(OC)c(O)cc32)cc1O |
| InChI | InChI=1S/C18H21NO4/c1-22-17-4-3-11(8-15(17)20)7-14-13-10-16(21)18(23-2)9-12(13)5-6-19-14/h3-4,8-10,14,19-21H,5-7H2,1-2H3/t14-/m1/s1 |
| InChIKey | FVEMXQCEJGGXJB-CQSZACIVSA-N |
| Roles Classification |
|---|
| Biological Role: | metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (R)-norreticuline (CHEBI:28658) is a norreticuline (CHEBI:46816) |
| (R)-norreticuline (CHEBI:28658) is conjugate base of (R)-norreticuline(1+) (CHEBI:193126) |
| (R)-norreticuline (CHEBI:28658) is enantiomer of (S)-norreticuline (CHEBI:28611) |
| Incoming Relation(s) |
| (R)-norreticuline(1+) (CHEBI:193126) is conjugate acid of (R)-norreticuline (CHEBI:28658) |
| (S)-norreticuline (CHEBI:28611) is enantiomer of (R)-norreticuline (CHEBI:28658) |
| IUPAC Name |
|---|
| (1R)-1-(3-hydroxy-4-methoxybenzyl)-6-methoxy-1,2,3,4-tetrahydroisoquinolin-7-ol |
| Synonyms | Source |
|---|---|
| (R)-Norreticuline | KEGG COMPOUND |
| (+)-norreticuline | ChEBI |
| N-Norreticuline | KEGG COMPOUND |
| Manual Xrefs | Databases |
|---|---|
| C06516 | KEGG COMPOUND |
| Registry Numbers | Sources |
|---|---|
| Beilstein:4711682 | Beilstein |