Compound Identification
SMILES
OC(=O)\C=C/C(O)=O.CC(C)N1C=C2C[C@@H]3[C@H](C=C(COC(=O)C4CCC4)CN3C)C3=C2C1=CC=C3
InChIKey
InChIKey=UXEQLDJMBAKLER-IQVRMLRVSA-N
Formula
C28H34N2O6
Mass
494.588
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
- Class Ergoline and derivatives
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Ergoline and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Ergoline and derivatives
Alternative Parents
Benzoquinolines Pyrroloquinolines 3-alkylindoles N-alkylindoles Isoindoles and derivatives Aralkylamines Unsaturated fatty acids Benzenoids Substituted pyrroles Dicarboxylic acids and derivatives Heteroaromatic compounds Carboxylic acid esters Trialkylamines Amino acids and derivatives Carboxylic acids Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Not available
Substituents
Ergoline skeleton - Benzoquinoline - Pyrroloquinoline - N-alkylindole - Quinoline - 3-alkylindole - Indole - Indole or derivatives - Isoindole or derivatives - Aralkylamine - Dicarboxylic acid or derivatives - Benzenoid - Fatty acid - Unsaturated fatty acid - Fatty acyl - Substituted pyrrole - Heteroaromatic compound - Pyrrole - Amino acid or derivatives - Tertiary amine - Tertiary aliphatic amine - Carboxylic acid ester - Azacycle - Carboxylic acid derivative - Carboxylic acid - Organoheterocyclic compound - Organooxygen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Amine - Carbonyl group - Organic nitrogen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as ergoline and derivatives. These are compounds containing an ergoline moiety, which is structurally characterized by he presence of a 4,6,6a,7,8,9,10,10a-octahydroindolo[4,3-fg] quinoline.
External Descriptors
Not available