Compound Identification
SMILES
CC[C@@]12C[C@H]3CN(C1)CCC1=C(NC4=CC=CC=C14)[C@@]([C@@H]3O2)(C(=O)OC)C1=C(OC)C=C2N(C)[C@@H]3[C@]4(CCN5CC=C[C@](CC)([C@@H]45)[C@@H](OC(C)=O)[C@]3(O)C(=O)OC)C2=C1
InChIKey
InChIKey=KMWVJRBQGMUMID-YFEYGGLVSA-N
Formula
C46H56N4O9
Mass
808.973
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
- Class Vinca alkaloids
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Vinca alkaloids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Vinca alkaloids
Alternative Parents
Carbazoles 3-alkylindoles Tricarboxylic acids and derivatives Anisoles Dialkylarylamines Aralkylamines Alkyl aryl ethers 1,4-oxazepines N-alkylpyrrolidines Piperidines Methyl esters Heteroaromatic compounds Tertiary alcohols Tetrahydrofurans Pyrroles Trialkylamines Amino acids and derivatives Cyclic alcohols and derivatives Oxacyclic compounds Dialkyl ethers Azacyclic compounds Hydrocarbon derivatives Organopnictogen compounds Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Vinca alkaloid skeleton - Carbazole - 3-alkylindole - Indole - Indole or derivatives - Tricarboxylic acid or derivatives - Anisole - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Para-oxazepine - Alkyl aryl ether - Aralkylamine - Piperidine - Benzenoid - N-alkylpyrrolidine - Cyclic alcohol - Heteroaromatic compound - Pyrrole - Pyrrolidine - Tertiary alcohol - Tetrahydrofuran - Methyl ester - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - Carboxylic acid ester - Organoheterocyclic compound - Azacycle - Oxacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Organooxygen compound - Organopnictogen compound - Carbonyl group - Organic oxide - Amine - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Alcohol - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as vinca alkaloids. These are alkaloids with a dimeric chemical structure composed of an indole nucleus (catharanthine), and a dihydroindole nucleus (vindoline), joined together.
External Descriptors
Not available