Tubulosine
(1R)-1-[[(2S,3R,11bS)-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl]methyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-6-ol
| Molecular Formula | C29H37N3O3 |
|---|---|
| Molecular Weight | 475.6 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 69.8 A2 |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 475.28348 |
| Heavy Atoms | 35 |
| Complexity | 723.0 |
Chemical Identifiers
| CAS Number | 2632-29-3 |
|---|---|
| SMILES | CCC1CN2CCC3=CC(=C(C=C3C2CC1CC4C5=C(CCN4)C6=C(N5)C=CC(=C6)O)OC)OC |
| InChIKey | JRVWIILYWSBUMC-PRUVNFMMSA-N |
📖 Product Overview
Tubulosine (CAS: 2632-29-3) is a chemical compound with molecular formula C29H37N3O3 and molecular weight 475.6 g/mol. Its IUPAC systematic name is (1R)-1-[[(2S,3R,11bS)-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl]methyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-6-ol.
JRVWIILYWSBUMC-PRUVNFMMSA-N.
SMILES: CCC1CN2CCC3=CC(=C(C=C3C2CC1CC4C5=C(CCN4)C6=C(N5)C=CC(=C6)O)OC)OC.
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