Compound Identification
SMILES
CC(C)NCC(O)C1=CC=C(NS(C)(=O)=O)C=C1.O=C1C[C@@H]2OCC=C3CN4CC[C@@]56[C@@H]4C[C@@H]3[C@@H]2[C@@H]5N1C1=CC=CC=C61
InChIKey
InChIKey=OMGWPMSFMZAQNK-ZEYGOCRCSA-N
Formula
C33H42N4O5S
Mass
606.78
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
- Class Strychnos alkaloids
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Strychnos alkaloids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Strychnos alkaloids
Alternative Parents
Carbazoles Quinolidines Sulfanilides Indolizidines Piperidinones Aralkylamines Delta lactams Organosulfonamides Organic sulfonamides N-alkylpyrrolidines Tertiary carboxylic acid amides Aminosulfonyl compounds Secondary alcohols Amino acids and derivatives 1,2-aminoalcohols Trialkylamines Oxacyclic compounds Dialkylamines Azacyclic compounds Dialkyl ethers Aromatic alcohols Hydrocarbon derivatives Organic oxides Carbonyl compounds
Molecular Framework
Not available
Substituents
Strychnan skeleton - Akuammicine-skeleton - Stemmadenine-skeleton - Carbazole - Sulfanilide - Quinolidine - Indolizidine - Indole or derivatives - Delta-lactam - Aralkylamine - Piperidinone - Benzenoid - N-alkylpyrrolidine - Piperidine - Organosulfonic acid amide - Organic sulfonic acid amide - Monocyclic benzene moiety - Aminosulfonyl compound - Tertiary carboxylic acid amide - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Pyrrolidine - Amino acid or derivatives - 1,2-aminoalcohol - Lactam - Secondary alcohol - Carboxamide group - Tertiary amine - Tertiary aliphatic amine - Oxacycle - Carboxylic acid derivative - Azacycle - Dialkyl ether - Secondary aliphatic amine - Ether - Organoheterocyclic compound - Secondary amine - Organic oxygen compound - Amine - Alcohol - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Aromatic alcohol - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as strychnos alkaloids. These are alkaloids having a core structure based on the strychnan, stemmadenine (seco-curan), or the akuammicine (curan) skeleton.
External Descriptors
Not available