Compound Identification
SMILES
CCC1(O)CC2CN(C1)CCC1=C(NC3=CC=CC=C13)C(C2)(C(=O)OC)C1=C(OC)C=C2N(C)C3C4(CCN5CC=CC(CC)(C45)C(O)C3(O)C(=O)NCCNC(=O)C3=C(O)C([125I])=C(C=C3)N=[N+]=[N-])C2=C1
InChIKey
InChIKey=INDAMCROFGPLSO-WJXVBXJFSA-N
Formula
C52H62IN9O9
Mass
1082.027
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
Carbazoles Quinoline carboxamides Salicylamides 3-alkylindoles 3-halobenzoic acids and derivatives Benzamides Anisoles Benzoyl derivatives Dialkylarylamines Phenylazides O-iodophenols Aralkylamines Alkyl aryl ethers Iodobenzenes 1-hydroxy-4-unsubstituted benzenoids Aryl iodides Piperidines N-alkylpyrrolidines Heteroaromatic compounds Pyrroles Tertiary alcohols Methyl esters Vinylogous acids 1,2-aminoalcohols Trialkylamines Cyclic alcohols and derivatives Amino acids and derivatives Secondary alcohols Secondary carboxylic acid amides Azo imides Azo compounds Azacyclic compounds Monocarboxylic acids and derivatives Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic zwitterions Organoiodides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Vinca alkaloid skeleton - Carbazole - Quinoline-6-carboxamide - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - 3-alkylindole - Salicylic acid or derivatives - Salicylamide - Benzamide - Benzoic acid or derivatives - Indole - Indole or derivatives - Phenylazide - 2-iodophenol - Dialkylarylamine - Tertiary aliphatic/aromatic amine - 2-halophenol - Benzoyl - Anisole - Alkyl aryl ether - 1-hydroxy-4-unsubstituted benzenoid - Halobenzene - Iodobenzene - Aralkylamine - Phenol - Monocyclic benzene moiety - Aryl iodide - Benzenoid - Aryl halide - N-alkylpyrrolidine - Piperidine - Cyclic alcohol - Heteroaromatic compound - Methyl ester - Vinylogous acid - Tertiary alcohol - Pyrrolidine - Pyrrole - Amino acid or derivatives - Carboxamide group - Azo compound - 1,2-aminoalcohol - Secondary carboxylic acid amide - Secondary alcohol - Carboxylic acid ester - Tertiary amine - Tertiary aliphatic amine - Azo imide - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Azacycle - Ether - Carboxylic acid derivative - Organic oxygen compound - Hydrocarbon derivative - Alcohol - Organic nitrogen compound - Amine - Organic zwitterion - Organohalogen compound - Organoiodide - Organopnictogen compound - Organic oxide - Carbonyl group - Organooxygen compound - 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