Voacangine
methyl (1S,15S,17S,18S)-17-ethyl-7-methoxy-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraene-1-carboxylate
| Molecular Formula | C22H28N2O3 |
|---|---|
| Molecular Weight | 368.5 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 54.6 A2 |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 368.21 |
| Heavy Atoms | 27 |
| Complexity | 598.0 |
Chemical Identifiers
| CAS Number | 510-22-5 |
|---|---|
| SMILES | CCC1CC2CC3(C1N(C2)CCC4=C3NC5=C4C=C(C=C5)OC)C(=O)OC |
| InChIKey | MMAYTCMMKJYIAM-RUGRQLENSA-N |
📖 Product Overview
Voacangine (CAS: 510-22-5) is a chemical compound with molecular formula C22H28N2O3 and molecular weight 368.5 g/mol. Its IUPAC systematic name is methyl (1S,15S,17S,18S)-17-ethyl-7-methoxy-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraene-1-carboxylate.
MMAYTCMMKJYIAM-RUGRQLENSA-N.
SMILES: CCC1CC2CC3(C1N(C2)CCC4=C3NC5=C4C=C(C=C5)OC)C(=O)OC.
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