Compound Identification
SMILES
COC1=CC=C(C=C1)S(=O)(=O)N1C[C@@H]2C[C@H](C1)C1=CC=C(NC(=O)C3=NC=CN=C3)C(=O)N1C2
InChIKey
InChIKey=YFNXTDPAJGSXCO-JKSUJKDBSA-N
Formula
C23H23N5O5S
Mass
481.53
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
-
Class
Lupin alkaloids
- Subclass Cytisine and derivatives
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Class
Lupin alkaloids
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Lupin alkaloids
Subclass
Cytisine and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Cytisine and derivatives
Alternative Parents
Benzenesulfonamides Benzenesulfonyl compounds Pyrazinecarboxamides 2-heteroaryl carboxamides Anisoles Methoxybenzenes Phenoxy compounds Alkyl aryl ethers Pyridinones Organosulfonamides Piperidines Heteroaromatic compounds Sulfonyls Lactams Secondary carboxylic acid amides Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cytisine - Benzenesulfonamide - Benzenesulfonyl group - Pyrazine carboxylic acid or derivatives - Pyrazinecarboxamide - 2-heteroaryl carboxamide - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Pyridinone - Monocyclic benzene moiety - Piperidine - Pyrazine - Pyridine - Benzenoid - Organosulfonic acid amide - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Heteroaromatic compound - Carboxamide group - Secondary carboxylic acid amide - Lactam - Ether - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organosulfur compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as cytisine and derivatives. These are lupin alkaloids with a structure based on the cytisine skeleton, which is a tetracyclic ketone containing fused pyridine and piperidine rings that form pyrido[1,2a][1,5]diazocin-8-one.
External Descriptors
Not available