Compound Identification
SMILES
OS(O)(=O)=O.CC[C@@]1(O)CN2CC[C@@H]1C[C@@H]2[C@@H](O)C1=C2C=C(OC)C=CC2=NC=C1
InChIKey
InChIKey=MMCFRFNECGZXQH-APFZWMIBSA-N
Formula
C20H28N2O7S
Mass
440.51
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
- Class Cinchona alkaloids
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Cinchona alkaloids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Cinchona alkaloids
Alternative Parents
4-quinolinemethanols Anisoles Quinuclidines Alkyl aryl ethers Aralkylamines Pyridines and derivatives Organic sulfuric acids Piperidines Heteroaromatic compounds Tertiary alcohols 1,2-aminoalcohols Secondary alcohols Trialkylamines Azacyclic compounds Hydrocarbon derivatives Aromatic alcohols Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cinchonan-skeleton - 4-quinolinemethanol - Quinoline - Anisole - Phenol ether - Quinuclidine - Alkyl aryl ether - Sulfuric acid - Aralkylamine - Benzenoid - Pyridine - Piperidine - Tertiary alcohol - Heteroaromatic compound - Organic sulfuric acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Secondary alcohol - 1,2-aminoalcohol - Azacycle - Organoheterocyclic compound - Ether - Aromatic alcohol - Organonitrogen compound - Alcohol - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Amine - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as cinchona alkaloids. These are alkaloids structurally characterized by the presence of the cinchonan skeleton, which consists of a quinoline linked to an azabicyclo[2.2.2]octane moiety.
External Descriptors
Not available