Compound Identification
SMILES
CC[C@@]12CC(C(=O)OC)=C3NC4=CC(O)=C(C=C4[C@@]33CCN(CC=C1)[C@@H]23)[C@H]1C[C@]2(CC)C=CCN3CCC4=C([C@H]23)N1C1=CC=CC=C41
InChIKey
InChIKey=XHINMKYMJPJTSG-DOOJHXRUSA-N
Formula
C40H44N4O3
Mass
628.817
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
- Class Eburnan-type alkaloids
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Eburnan-type alkaloids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Eburnan-type alkaloids
Alternative Parents
Plumeran-type alkaloids Indolonaphthyridine alkaloids Beta carbolines Carbazoles 3-alkylindoles Naphthyridines Indolines 1-hydroxy-2-unsubstituted benzenoids Aralkylamines Secondary alkylarylamines N-alkylpyrrolidines Vinylogous amides Methyl esters Pyrroles Heteroaromatic compounds Enoate esters Amino acids and derivatives Trialkylamines Monocarboxylic acids and derivatives Enamines Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Eburna alkaloid - Plumeran-type alkaloid - Indolo[3,2-1de][1,5]naphthyridine - Beta-carboline - Carbazole - Pyridoindole - Naphthyridine - 3-alkylindole - Indole - Indole or derivatives - Dihydroindole - 1-hydroxy-2-unsubstituted benzenoid - Aralkylamine - Phenol - Secondary aliphatic/aromatic amine - Benzenoid - N-alkylpyrrolidine - Enoate ester - Pyrrolidine - Pyrrole - Alpha,beta-unsaturated carboxylic ester - Methyl ester - Vinylogous amide - Heteroaromatic compound - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - Carboxylic acid ester - Secondary amine - Carboxylic acid derivative - Enamine - Azacycle - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Organic oxide - Organooxygen compound - Amine - Hydrocarbon derivative - Organonitrogen compound - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as eburnan-type alkaloids. These are alkaloids with a structure based on the eburnan skeleton, that arises from rearrangement of the aspidospermidine ring system, involving migration of C-21 from C-7 to C-2, fission of the 2,16-bond, and attachment of C-16 to N-1.
External Descriptors
Not available