Compound Identification
SMILES
CC[C@@]1(O)C(=O)OCC2=C1C=C1N(C(CC(C)=O)C3=C1N=C1C=CC=C(C1=C3)[N+]([O-])=O)C2=O
InChIKey
InChIKey=WEVKJFULQRGEKE-IMMUGOHXSA-N
Formula
C23H19N3O7
Mass
449.419
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
- Class Camptothecins
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Camptothecins
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Camptothecins
Alternative Parents
Nitroquinolines and derivatives Pyranopyridines Nitroaromatic compounds Pyridinones Benzenoids Tertiary alcohols Heteroaromatic compounds Carboxylic acid esters Ketones Lactams Lactones Monocarboxylic acids and derivatives Oxacyclic compounds Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organonitrogen compounds Hydrocarbon derivatives Organic zwitterions Organic oxides Organic salts
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Camptothecin - Nitroquinoline - Pyranopyridine - Quinoline - Nitroaromatic compound - Pyridinone - Pyridine - Benzenoid - Heteroaromatic compound - Tertiary alcohol - Carboxylic acid ester - Ketone - Lactam - Lactone - C-nitro compound - Organic nitro compound - Organic 1,3-dipolar compound - Azacycle - Oxacycle - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organic oxoazanium - Carboxylic acid derivative - Organic salt - Organic oxygen compound - Organonitrogen compound - Carbonyl group - Organic nitrogen compound - Organic zwitterion - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Alcohol - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as camptothecins. These are heterocyclic compounds comprising a planar pentacyclic ring structure, that includes a pyrrolo[3,4-beta]-quinoline moiety (rings A, B and C), conjugated pyridone moiety (ring D) and one chiral center at position 20 within the alpha-hydroxy lactone ring with (S) configuration (the E-ring).
External Descriptors
Not available