Evodiamine, derivative of
21-methyl-3,13-diaza-21-azoniapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-1(21),2(10),4,6,8,15,17,19-octaen-14-one
Also Known As: Dehydroevodiamine|Dehydroevidiamine|Dehydroevodiamine HCl|Evodiamine, derivative of|Dehydroevodiamine chloride|Dehydroevodiamine Hydrochloride|AK-693/21141027|14-Methyl-5-oxo-5,7,8,13-tetrahydro-indolo[2'',3'':3,4]pyrido[2,1-b]quinazolin-14-ium
| Molecular Formula | C19H16N3O+ |
|---|---|
| Molecular Weight | 302.12933 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 39.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 302.12933 |
| Monoisotopic Mass | 302.12933 |
| Heavy Atoms | 23 |
| Complexity | 557.0 |
Chemical Identifiers
| CAS Number | 67909-49-3 |
|---|---|
| SMILES | C[N+]1=C2C3=C(CCN2C(=O)C4=CC=CC=C41)C5=CC=CC=C5N3 |
| InChIKey | VXHNSVKJHXSKKM-UHFFFAOYSA-O |
Product Overview
Evodiamine, derivative of (CAS 67909-49-3), with molecular formula C19H16N3O+ and molecular weight 302.12933 g/mol. IUPAC: 21-methyl-3,13-diaza-21-azoniapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-1(21),2(10),4,6,8,15,17,19-octaen-14-one.
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