主记录
C21H31NO4
- CAS
- 1212483-65-2
- PubChem CID
- 11873889
- SMILES
- CCCCCC1=CC=C(C(=O)O1)C(=O)OC[C@@H]2CCCN3[C@@H]2CCCC3
- 分子式
- C21H31NO4
- 分子量
- 361.482
- 精确分子量
- 361.2253
- InChI
- InChI=1S/C21H31NO4/c1-2-3-4-9-17-11-12-18(21(24)26-17)20(23)25-15-16-8-7-14-22-13-6-5-10-19(16)22/h11-12,16,19H,2-10,13-15H2,1H3/t16-,19+/m0/s1
- InChIKey
- IBTXHLUOGHLSCI-QFBILLFUSA-N
- LogP
- 3.7938
- TPSA
- 59.75
名称与别名
- C21H31NO4
- ZINC4028787
- STL562473
- AKOS030492879
- CID11873889
- ((1R,9aR)-octahydro-1H-quinolizin-1-yl)methyl 2-oxo-6-pentyl-2H-pyran-3-carboxylate
- (1R,9aR)-octahydro-2H-quinolizin-1-ylmethyl 2-oxo-6-pentyl-2H-pyran-3-carboxylate
- 2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-ylmethyl 2-oxo-6-pentyl-pyran-3-carboxylate
- 1212483-65-2