Compound Identification
SMILES
OC(C(O)C(O)=O)C(O)=O.CCC1C2CC3C4N(C)C5=C(C=C(Br)C=C5)C44CC(C2C4O)[N+]3(CC(O)CN2CCCCC2)C1O
InChIKey
InChIKey=VGPJMZXDDQKDPF-UHFFFAOYSA-N
Formula
C32H47BrN3O9
Mass
697.643
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 Dialkylarylamines Quinuclidines Beta hydroxy acids and derivatives Azepanes Sugar acids and derivatives Short-chain hydroxy acids and derivatives Aralkylamines Dicarboxylic acids and derivatives Benzenoids Aryl bromides Piperidines Alpha hydroxy acids and derivatives Monosaccharides Fatty acids and conjugates Tetraalkylammonium salts 1,2-aminoalcohols Trialkylamines Secondary alcohols Cyclic alcohols and derivatives Hemiaminals Carboxylic acids Azacyclic compounds Organic oxides Organic salts Organobromides Carbonyl compounds Organopnictogen compounds Hydrocarbon derivatives Organic cations
Molecular Framework
Not available
Substituents
Sarpagine-skeleton - Beta-carboline - Pyridoindole - Quinolizidine - Indole or derivatives - Quinuclidine - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aralkylamine - Azepane - Sugar acid - Short-chain hydroxy acid - Beta-hydroxy acid - Aryl bromide - Fatty acid - Aryl halide - Benzenoid - Hydroxy acid - Monosaccharide - Dicarboxylic acid or derivatives - Alpha-hydroxy acid - Piperidine - Cyclic alcohol - Tetraalkylammonium salt - Hemiaminal - Tertiary aliphatic amine - 1,2-aminoalcohol - Tertiary amine - Secondary alcohol - Azacycle - Carboxylic acid - Carboxylic acid derivative - Organoheterocyclic compound - Alkanolamine - Organic nitrogen compound - Organic oxygen compound - Organohalogen compound - Organobromide - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic salt - Hydrocarbon derivative - Amine - Organic oxide - Organopnictogen compound - Alcohol - Organic cation - 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