Rauwolscine
methyl (1S,15S,19S,20S)-18-hydroxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate
Also Known As: Rauwolscine|Corynanthidine|Mesoyohimbine|Isoyohimbine|alpha-Yohimbine|EINECS 205-006-9|TN3393|methyl(16|A,20|A)-17-hydroxyyohimban-16-carboxylate|Methyl (16beta,17alpha,20alpha)-17-hydroxyyohimban-16-carboxylate|17-alpha-Hydroxy-20-alpha-yohimban-16-beta-carboxylic acid methyl ester|20-alpha-Yohimban-16-beta-carboxylic acid, 17-alpha-hydroxy-, methyl ester|Yohimban-16-carboxylic acid, 17-hydroxy-, methyl ester, (16-beta,17-alpha,20-alpha)-|Yohimban-16-carboxylic acid, 17-hydroxy-, methyl ester, (16beta,17alpha,20alpha)- (9CI)
| Molecular Formula | C21H26N2O3 |
|---|---|
| Molecular Weight | 354.19434 g/mol |
| LogP | 2.65 |
| Topological Polar Surface Area | 65.56 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 354.19434 |
| Heavy Atoms | 26 |
| Complexity | 844.9 |
Chemical Identifiers
| CAS Number | 131-03-3 |
|---|---|
| SMILES | COC(=O)[C@H]1[C@H]2C[C@H]3C4=C(CCN3C[C@H]2CCC1O)C5=CC=CC=C5N4 |
Product Overview
Rauwolscine (CAS 131-03-3), with molecular formula C21H26N2O3 and molecular weight 354.19434 g/mol. IUPAC: methyl (1S,15S,19S,20S)-18-hydroxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate.
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