Compound Identification
SMILES
OS(O)(=O)=O.CC[C@]1(O)CC2CN(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(=O)CN(C)C)[C@]3(O)C(=O)OC)C2=C1
InChIKey
InChIKey=UNMODLJJNIJIBD-KLAPOHTHSA-N
Formula
C48H65N5O13S
Mass
952.13
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
Alpha amino acid esters Carbazoles 3-alkylindoles Tricarboxylic acids and derivatives Anisoles Dialkylarylamines Alkyl aryl ethers Aralkylamines Piperidines Organic sulfuric acids N-alkylpyrrolidines Heteroaromatic compounds Pyrroles Methyl esters Tertiary alcohols Cyclic alcohols and derivatives Trialkylamines 1,2-aminoalcohols Azacyclic compounds Organic oxides Carbonyl compounds Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Vinca alkaloid skeleton - Alpha-amino acid ester - Carbazole - Alpha-amino acid or derivatives - 3-alkylindole - Indole - Indole or derivatives - Tricarboxylic acid or derivatives - Tertiary aliphatic/aromatic amine - Anisole - Dialkylarylamine - Alkyl aryl ether - Aralkylamine - Sulfuric acid - Piperidine - N-alkylpyrrolidine - Benzenoid - Cyclic alcohol - Heteroaromatic compound - Organic sulfuric acid or derivatives - Methyl ester - Pyrrole - Pyrrolidine - Tertiary alcohol - Tertiary amine - Tertiary aliphatic amine - Amino acid or derivatives - 1,2-aminoalcohol - Carboxylic acid ester - Organoheterocyclic compound - Azacycle - Ether - Carboxylic acid derivative - Organonitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organic oxygen compound - Organopnictogen compound - Amine - Alcohol - Organic nitrogen 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