EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C17H27NO2 |
| Net Charge | 0 |
| Average Mass | 277.408 |
| Monoisotopic Mass | 277.20418 |
| SMILES | CC(/C=C/C1CC1)=C\[C@H]1[C@H](O)[C@@](C)(O)[C@H]2CCCCN12 |
| InChI | InChI=1S/C17H27NO2/c1-12(6-7-13-8-9-13)11-14-16(19)17(2,20)15-5-3-4-10-18(14)15/h6-7,11,13-16,19-20H,3-5,8-10H2,1-2H3/b7-6+,12-11+/t14-,15+,16-,17-/m0/s1 |
| InChIKey | ABNQIBOOQKGLRG-BPODRKPHSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Streptomycesspecies HNA39 (ncbitaxon:2850561) | - | PubMed (29389122) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Cyclizidine B (CHEBI:208904) is a indolizines (CHEBI:38485) |
| IUPAC Name |
|---|
| (1S,2S,3S,8aR)-3-[(1E,3E)-4-cyclopropyl-2-methylbuta-1,3-dienyl]-1-methyl-3,5,6,7,8,8a-hexahydro-2H-indolizine-1,2-diol |
| Manual Xrefs | Databases |
|---|---|
| 64849030 | ChemSpider |