Compound Identification
SMILES
O[C@H]([C@@H](O)C([O-])=O)C(O)=O.CCC[N+]12[C@H]3C[C@]45[C@H](O)C3[C@@H](C[C@H]1[C@@H]4N(C)C1=CC=CC=C51)[C@H](CC)[C@H]2O
InChIKey
InChIKey=VZAUGYDMVQSQAO-NHKMMWDGSA-M
Formula
C27H38N2O8
Mass
518.607
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Ajmaline-sarpagine alkaloids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Ajmaline-sarpagine alkaloids
Alternative Parents
Beta carbolines Quinolizidines Quinuclidines Dialkylarylamines Sugar acids and derivatives Short-chain hydroxy acids and derivatives Beta hydroxy acids and derivatives Azepanes Aralkylamines Piperidines Monosaccharides Fatty acids and conjugates Dicarboxylic acids and derivatives Benzenoids Alpha hydroxy acids and derivatives Tetraalkylammonium salts Secondary alcohols Hemiaminals Cyclic alcohols and derivatives Carboxylic acids Azacyclic compounds Organopnictogen compounds Organic zwitterions Organic salts Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Not available
Substituents
Sarpagine-skeleton - Pyridoindole - Beta-carboline - Quinolizidine - Indole or derivatives - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Quinuclidine - Aralkylamine - Sugar acid - Short-chain hydroxy acid - Beta-hydroxy acid - Azepane - Fatty acid - Benzenoid - Piperidine - Monosaccharide - Hydroxy acid - Dicarboxylic acid or derivatives - Alpha-hydroxy acid - Tetraalkylammonium salt - Cyclic alcohol - Tertiary amine - Secondary alcohol - Hemiaminal - Azacycle - Organoheterocyclic compound - Carboxylic acid - Carboxylic acid derivative - Alkanolamine - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic salt - Organic zwitterion - Organooxygen compound - Organonitrogen compound - Carbonyl group - Amine - Alcohol - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as ajmaline-sarpagine alkaloids. These are organic compounds containing either of the ajmalan, sarpagan skeleton, or derivative thereof. The Sarpagine (Akuammidine) group, based on the sarpagan nucleus, arises from bond formation between C-16 and C-5 of the corynantheine precursor. Ajmaline alkaloids are based on a 17,19-secoyohimban skeleton (oxayohimban) which is invariably present as an ether.
External Descriptors
Not available