Compound Identification
SMILES
O[C@H]([C@@H](O)C(O)=O)C(O)=O.CC[C@H]1[C@H](O)N2[C@H]3CC45[C@@H](O)C3C1C[C@H]2[C@@H]4N(C)C1=C5C=C(Br)C=C1
InChIKey
InChIKey=VZJRHEHUVOQEHV-ZIEFDSRFSA-N
Formula
C24H31BrN2O8
Mass
555.422
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 Aryl bromides Piperidines Benzenoids Dicarboxylic acids and derivatives Cyclic alcohols and derivatives Secondary alcohols Hemiaminals Azacyclic compounds Organopnictogen compounds Organobromides Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
Sarpagine-skeleton - Beta-carboline - Pyridoindole - Quinolizidine - Indole or derivatives - Dialkylarylamine - Quinuclidine - Tertiary aliphatic/aromatic amine - Azepane - Aralkylamine - Aryl bromide - Aryl halide - Dicarboxylic acid or derivatives - Piperidine - Benzenoid - Cyclic alcohol - Tertiary amine - Secondary alcohol - Hemiaminal - Organoheterocyclic compound - Azacycle - Alkanolamine - Organonitrogen compound - Organopnictogen compound - Organic oxygen compound - Alcohol - Organic nitrogen compound - Organooxygen compound - Amine - Organobromide - Hydrocarbon derivative - Organohalogen compound - 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