Vobasin
methyl 15-ethylidene-17-methyl-12-oxo-10,17-diazatetracyclo[12.3.1.03,11.04,9]octadeca-3(11),4,6,8-tetraene-18-carboxylate
Also Known As: Vobasine|Vobasin|(-)-Vobasine|methyl 3-oxovobasan-17-oate|Vobasan-17-oic acid, methyl ester|methyl (1S,14R,15E,18S)-15-ethylidene-17-methyl-12-oxo-10,17-diazatetracyclo[12.3.1.03,11.04,9]octadeca-3(11),4,6,8-tetraene-18-carboxylate|methyl 15-ethylidene-17-methyl-12-oxo-10,17-diazatetracyclo[12.3.1.03,11.04,9]octadeca-3(11),4,6,8-tetraene-18-carboxylate
CAS: 2134-83-0
| Molecular Formula | C21H24N2O3 |
|---|---|
| Molecular Weight | 352.17868 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 62.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 352.17868 |
| Monoisotopic Mass | 352.17868 |
| Heavy Atoms | 26 |
| Complexity | 616.0 |
Chemical Identifiers
| CAS Number | 2134-83-0 |
|---|---|
| SMILES | CC=C1CN(C2CC3=C(C(=O)CC1C2C(=O)OC)NC4=CC=CC=C34)C |
| InChIKey | TYPMTMPLTVSOBU-UHFFFAOYSA-N |
Product Overview
Vobasin (CAS 2134-83-0), with molecular formula C21H24N2O3 and molecular weight 352.17868 g/mol. IUPAC: methyl 15-ethylidene-17-methyl-12-oxo-10,17-diazatetracyclo[12.3.1.03,11.04,9]octadeca-3(11),4,6,8-tetraene-18-carboxylate.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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