Eseramine
[(3aS,8bS)-4,8b-dimethyl-3-(methylcarbamoyl)-2,3a-dihydro-1H-pyrrolo[2,3-b]indol-7-yl] N-methylcarbamate
Also Known As: Eseramine|(-)-eseramine|Ethyl 2-bromobenzoate|ESERAMINE, (-)-|SureCN2685980|[(3aS,8bS)-4,8b-dimethyl-3-(methylcarbamoyl)-2,3a-dihydro-1H-pyrrolo[2,3-b]indol-7-yl] N-methylcarbamate|Pyrrolo(2,3-b)indole-1(2H)-carboxamide, 3,3a,8,8a-tetrahydro-N,3a,8-trimethyl-5-(((methylamino)carbonyl)oxy)-, (3aS-cis)-|(3AS,8AS)-3,3A,8,8A-TETRAHYDRO-N,3A,8-TRIMETHYL-5-(((METHYLAMINO)CARBONYL)OXY)PYRROLO(2,3-B)INDOLE-1(2H)-CARBOXAMIDE|(3aS-cis)-3,3a,8,8a-Tetrahydro-N,3a,8-trimethyl-5-[[(methylamino)carbonyl]oxy]-pyrrolo[2,3-b]indole-1(2H)-carboxamide|PYRROLO(2,3-B)INDOLE-1(2H)-CARBOXAMIDE, 3,3A,8,8A-TETRAHYDRO-N,3A,8-TRIMETHYL-5-(((METHYLAMINO)CARBONYL)OXY)-, (3AS,8AS)-|((3aS,8bS)-4,8b-dimethyl-3-(methylcarbamoyl)-2,3a-dihydro-1H-pyrrolo(2,3-b)indol-7-yl) N-methylcarbamate|(3aS,8aS)-3,3a,8,8a-Tetrahydro-N,3a,8-trimethyl-5-[(methylcarbamoyl)oxy]pyrrolo[2,3-b]indole-1(2H)-carboxamide|(3aS,8aS)-3,3a,8,8a-Tetrahydro-N,3a,8-trimethyl-5-[[(methylamino)carbonyl]oxy]pyrrolo[2,3-b]indole-1(2H)-carboxamide|(3AS,8AS)-3A,8-DIMETHYL-1-(METHYLCARBAMOYL)-1H,2H,3H,3AH,8H,8AH-PYRROLO[2,3-B]INDOL-5-YL N-METHYLCARBAMATE|(3aS,8aS)-5-[Hydroxy(methylimino)methoxy]-N,3a,8-trimethyl-3,3a,8,8a-tetrahydropyrrolo[2,3-b]indole-1(2H)-carboximidic acid|(3AS-cis)-3,3a,8,8a-tetrahydro-N,3a,8-trimethyl-5-(((methylamino)carbonyl)oxy)-pyrrolo(2,3-b)indole-1(2H)-carboxamide|5-[Hydroxy(methylimino)methoxy]-N,3a,8-trimethyl-3,3a,8,8a-tetrahydropyrrolo[2,3-b]indole-1(2H)-carboximidic acid
| Molecular Formula | C16H22N4O3 |
|---|---|
| Molecular Weight | 318.1692 g/mol |
| Topological Polar Surface Area | 73.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 318.1692 |
| Monoisotopic Mass | 318.1692 |
| Heavy Atoms | 23 |
| Complexity | 500.0 |
Chemical Identifiers
| CAS Number | 6091-57-2 |
|---|---|
| SMILES | C[C@@]12CCN([C@@H]1N(C3=C2C=C(C=C3)OC(=O)NC)C)C(=O)NC |
| InChIKey | PYEMNABYODPRPP-BBRMVZONSA-N |
Product Overview
Eseramine (CAS 6091-57-2), with molecular formula C16H22N4O3 and molecular weight 318.1692 g/mol. IUPAC: [(3aS,8bS)-4,8b-dimethyl-3-(methylcarbamoyl)-2,3a-dihydro-1H-pyrrolo[2,3-b]indol-7-yl] N-methylcarbamate.