EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C10H13NO3 |
| Net Charge | 0 |
| Average Mass | 195.218 |
| Monoisotopic Mass | 195.08954 |
| SMILES | CN1Cc2cc(O)c(O)cc2C(O)C1 |
| InChI | InChI=1S/C10H13NO3/c1-11-4-6-2-8(12)9(13)3-7(6)10(14)5-11/h2-3,10,12-14H,4-5H2,1H3 |
| InChIKey | PIJDIPDQQMXWEM-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-methyl-4,6,7-trihydroxy-1,2,3,4-tetrahydroisoquinoline (CHEBI:173958) is a isoquinolines (CHEBI:24922) |
| IUPAC Name |
|---|
| 2-methyl-3,4-dihydro-1H-isoquinoline-4,6,7-triol |
| Manual Xrefs | Databases |
|---|---|
| 138911 | ChemSpider |
| HMDB0060065 | HMDB |
| Registry Numbers | Sources |
|---|---|
| CAS:82563-75-5 | ChemIDplus |