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loading...| Preferred Name |
epibatidine |
| Synonyms |
CMI-488 (1R,2R,4S)-2-(6-chloropyridin-3-yl)-7-azabicyclo[2.2.1]heptane CMI 488 epibatidine |
| ID |
http://purl.obolibrary.org/obo/CHEBI_4803 |
| charge |
0 |
| database_cross_reference |
KNApSAcK:C00028244 DrugBank:DB07720 PMID:20337496 KEGG:C11690 PMID:16193063 PMID:8112391 PDBeChem:EPJ PMID:21909087 Wikipedia:Epibatidine CAS:140111-52-0 |
| formula |
C11H13ClN2 |
| has_alternative_id |
CHEBI:47399 |
| has_exact_synonym |
epibatidine |
| has_obo_namespace |
chebi_ontology |
| has_related_synonym |
CMI-488 (1R,2R,4S)-2-(6-chloropyridin-3-yl)-7-azabicyclo[2.2.1]heptane CMI 488 |
| id |
CHEBI:4803 |
| in_subset | |
| inchi |
InChI=1S/C11H13ClN2/c12-11-4-1-7(6-13-11)9-5-8-2-3-10(9)14-8/h1,4,6,8-10,14H,2-3,5H2/t8?,9-,10+/m1/s1 |
| inchikey |
NLPRAJRHRHZCQQ-XVBQNVSMSA-N |
| label |
epibatidine |
| mass |
208.690 |
| monoisotopicmass |
208.07673 |
| notation |
CHEBI:4803 |
| prefLabel |
epibatidine |
| smiles |
C12C[C@@]([C@@H](N1)CC2)(C=3C=NC(=CC3)Cl)[H] |
| treeView | |
| subClassOf |
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| Delete | Mapping To | Ontology | Source |
|---|---|---|---|
| http://purl.bioontology.org/ontology/MESH/C082748 | Medical Subject Headings / 医学主题词表 | LOOM |