Compound Identification
SMILES
COC(=O)[C@H]1[C@H]2C[C@H](C=C3[C@@H]4CCN(C\C4=C\C)CC4=C3NC3=CC=CC=C43)C3=C(C[C@@H]1[N+](C)([O-])C\C2=C\C)C1=CC=CC=C1N3
InChIKey
InChIKey=RAFFWWJODWWBKO-RKGODHLESA-N
Formula
C39H44N4O3
Mass
616.806
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
- Class Vobasan alkaloids
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Vobasan alkaloids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Vobasan alkaloids
Alternative Parents
Vallesaman alkaloids 3-alkylindoles Piperidinecarboxylic acids Aralkylamines Benzenoids Trialkyl amine oxides Methyl esters Heteroaromatic compounds Pyrroles Trialkylamines Amino acids and derivatives Monocarboxylic acids and derivatives Trisubstituted amine oxides and derivatives Azacyclic compounds Organic zwitterions Organic salts Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Vallesaman-skeleton - Vobasan skeleton - 3-alkylindole - Indole - Indole or derivatives - Piperidinecarboxylic acid - Aralkylamine - Benzenoid - Piperidine - Trialkyl amine oxide - Heteroaromatic compound - Methyl ester - Pyrrole - Carboxylic acid ester - Amino acid or derivatives - Tertiary amine - Tertiary aliphatic amine - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - N-oxide - Monocarboxylic acid or derivatives - Trisubstituted n-oxide - Organonitrogen compound - Carbonyl group - Amine - Organic salt - Organooxygen compound - Organic zwitterion - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as vobasan alkaloids. These are alkaloids containing the vobasan skeleton.
External Descriptors
Not available