Compound Identification
SMILES
COC(=O)[C@@]12C[C@]3(C=C)C=C[C@@H]4N5[C@H](C[C@]1([C@H]35)C1=CC=CC=C1NC2=O)C12C3=C5C6=C7C8=C9C%10=C%11C%12=C%13C%14=C%10C%10=C9C9=C%15C%16=C%17C%18=C%19C%20=C%21C%22=C%23C%24=C%25C%26=C(C6=C8C%11=C%26C%12=C%24C%22=C%13C%20=C%14C%18=C%10%16)C6=C%25C8=C(C%10=C%11C(C%19=C%21C%10=C%238)=C%17C(=C%15C3=C79)C41%11)C2=C56
InChIKey
InChIKey=JWJCKHYAKSURSU-OLRKITITSA-N
Formula
C81H20N2O3
Mass
1069.062
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
- Class Melodinus alkaloids
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Melodinus alkaloids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Melodinus alkaloids
Alternative Parents
Triphenylenes Chrysenes Hydroquinolones Hydroquinolines Naphthalenes Isoindolines Pyrrolizidines Aralkylamines N-alkylpyrrolidines Methyl esters Lactams Secondary carboxylic acid amides Amino acids and derivatives Trialkylamines Monocarboxylic acids and derivatives Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Melodinus skeleton - Chrysene - Triphenylene - Phenanthrene - Tetrahydroquinolone - Quinolone - Tetrahydroquinoline - Naphthalene - Isoindoline - Isoindole or derivatives - Pyrrolizidine - Aralkylamine - Benzenoid - N-alkylpyrrolidine - Methyl ester - Pyrrolidine - Secondary carboxylic acid amide - Amino acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Carboxamide group - Carboxylic acid ester - Lactam - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Amine - Organonitrogen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as melodinus alkaloids. These are alkaloids with a structure that is based on the melodinus skeleton. This backbone is a pentacyclic structure that contains a tetrahydroquinoline and an indolizine joined to each other through a cyclopentane.
External Descriptors
Not available