Compound Identification
SMILES
[Br-].CC[C@@H]1[C@@H](O)[N+]2(CC=C)[C@H]3CC45[C@H](O)C3C1C[C@H]2[C@@H]4N(C)C1=CC=CC=C51
InChIKey
InChIKey=FVJYANBRYOGVGH-UTZXWTGVSA-M
Formula
C23H31BrN2O2
Mass
447.417
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 Aralkylamines Azepanes Benzenoids Piperidines Tetraalkylammonium salts Hemiaminals Cyclic alcohols and derivatives Secondary alcohols Azacyclic compounds Hydrocarbon derivatives Organopnictogen compounds Organic bromide salts Organic zwitterions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Sarpagine-skeleton - Beta-carboline - Pyridoindole - Quinolizidine - Indole or derivatives - Dialkylarylamine - Quinuclidine - Tertiary aliphatic/aromatic amine - Azepane - Aralkylamine - Piperidine - Benzenoid - Tetraalkylammonium salt - Cyclic alcohol - Hemiaminal - Secondary alcohol - Tertiary amine - Organoheterocyclic compound - Azacycle - Alkanolamine - Organic salt - Organic bromide salt - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - Amine - Organic zwitterion - 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