Compound Identification
SMILES
OS(O)(=O)=O.CC[C@@]1(O)C[C@H]2CN(C1)CCC1=C(NC3=CC=CC=C13)[C@@](C2)(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=KDQAABAKXDWYSZ-CJWHBHTLSA-N
Formula
C46H60N4O13S
Mass
909.06
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 Dialkylarylamines Anisoles Aralkylamines Alkyl aryl ethers Piperidines Organic sulfuric acids N-alkylpyrrolidines Tertiary alcohols Pyrroles Methyl esters Heteroaromatic compounds Trialkylamines Cyclic alcohols and derivatives Amino acids and derivatives 1,2-aminoalcohols Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Vinca alkaloid skeleton - Carbazole - 3-alkylindole - Tricarboxylic acid or derivatives - Indole or derivatives - Indole - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Anisole - Aralkylamine - Sulfuric acid - Alkyl aryl ether - Benzenoid - N-alkylpyrrolidine - Piperidine - Heteroaromatic compound - Methyl ester - Tertiary alcohol - Pyrrolidine - Pyrrole - Organic sulfuric acid or derivatives - Cyclic alcohol - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid ester - Amino acid or derivatives - 1,2-aminoalcohol - Azacycle - Organoheterocyclic compound - Ether - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Amine - Alcohol - 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