Compound Identification
SMILES
OC(=O)C(F)(F)F.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)C3C4(CCN5CC=C[C@](CC)(C45)[C@@H](OC(=O)CN)[C@]3(O)C(=O)OC)C2=C1
InChIKey
InChIKey=IMXIYRIEAYVYKJ-FRJZMVIOSA-N
Formula
C48H60F3N5O11
Mass
940.027
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 N-alkylpyrrolidines Tertiary alcohols Pyrroles Methyl esters Heteroaromatic compounds Cyclic alcohols and derivatives 1,2-aminoalcohols Trialkylamines Azacyclic compounds Carbonyl compounds Monoalkylamines Organic oxides Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
Vinca alkaloid skeleton - Alpha-amino acid ester - Carbazole - Alpha-amino acid or derivatives - 3-alkylindole - Indole - Indole or derivatives - Tricarboxylic acid or derivatives - Anisole - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Alkyl aryl ether - Aralkylamine - Piperidine - Benzenoid - N-alkylpyrrolidine - Cyclic alcohol - Heteroaromatic compound - Pyrrole - Pyrrolidine - Tertiary alcohol - Methyl ester - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - Carboxylic acid ester - 1,2-aminoalcohol - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Azacycle - Organonitrogen compound - Primary amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organic nitrogen compound - Organic oxygen compound - Primary aliphatic amine - Amine - Alcohol - Organopnictogen 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