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Structure
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|
| Relationships |
Total Number of functionally related protein(s) :
75
Total Number of Articles : 105
|
| PubChem |
656665
|
| Molecular Formula |
C17H20N2O2 |
| SMILES |
CN1[C@@H]2CC[C@H]1CC(C2)OC(=O)C3=CNC4=CC=CC=C43 |
| InChI |
InChI=1S/C17H20N2O2/c1-19-11-6-7-12(19)9-13(8-11)21-17(20)15-10-18-16-5-3-2-4-14(15)16/h2-5,10-13,18H,6-9H2,1H3/t11-,12+,13? |
| synonyms |
- tropisetron
- 89565-68-4
- Tropisetronum
- Tropisteron
- [(1R,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] 1H-indole-3-carboxylate
- Tropisetron (INN)
- ICS 205930
- Tropisetron [INN:BAN]
- Tropisetronum [INN-Latin]
- (3-endo)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl 1H-indole-3-carboxylate
- ICS-205930
- ICF 205-930
- 6I819NIK1W
- DTXSID2044137
- CHEBI:32269
- TROPISETRON [MI]
- TROPISETRON [INN]
- ICS-205-930
- TROPISETRON [MART.]
- TROPISETRON [WHO-DD]
- DTXCID40819895
- 1alphaH,5alphaH-Tropan-3alpha-yl indole-3-carboxylate
- Tropisetronum (INN-Latin)
- 1H-Indole-3-carboxylic acid, 8-methyl-8-azabicyclo(3.2.1)oct-3-yl ester, endo-
- TROPISETRON (MART.)
- 1.ALPHA.H,5.ALPHA.H-TROPAN-3.ALPHA.-YL INDOLE-3-CARBOXYLATE
- (3-endo)-8-methyl-8-azabicyclo(3.2.1)oct-3-yl 1H-indole-3-carboxylate
- ((1R,5S)-8-methyl-8-azabicyclo(3.2.1)octan-3-yl) 1H-indole-3-carboxylate
- (1R,3R,5S)-8-methyl-8-azabicyclo(3.2.1)octan-3-yl 1H-indole-3-carboxylate
- (1R,3r,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl 1H-indole-3-carboxylate
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| Properties |
| Property |
Value |
| MW |
284.35 g/mol |
| HBD |
1 |
| HBA |
3 |
| Rotatable Bond Count |
3 |
| Exact Mass |
284.152477885 g/mol |
| Monoisotopic Mass |
284.152477885 g/mol |
| Heavy Atom Count |
21 |
| Isotope Atom Count |
0 |
| Atom Stereo Count |
2 |
| Covalent Unit Count |
1 |
| Complexity |
400 |
| xlogp |
3.8 |
| Topological Polar Surface Area |
45.3 |
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