Compound Identification
SMILES
CC[C@@]1([O-])C(=O)OCC2=C1C=C1N(CC3=C1N=C1C=CC(OCCC[N+]4=CC=CC=C4)=C(C1=C3)[N+]([O-])=O)C2=O
InChIKey
InChIKey=UTKUXNXACWIYLQ-NDEPHWFRSA-N
Formula
C28H24N4O7
Mass
528.521
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 Phenol ethers Nitroaromatic compounds Pyridinones Alkyl aryl ethers Pyridinium derivatives Heteroaromatic compounds Lactones Lactams Carboxylic acid esters Organic oxoazanium compounds Oxacyclic compounds Monocarboxylic acids and derivatives Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxides Organonitrogen compounds Hydrocarbon derivatives Alkoxides Carbonyl compounds Organic salts Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Camptothecin - Nitroquinoline - Quinoline - Pyranopyridine - Nitroaromatic compound - Phenol ether - Alkyl aryl ether - Pyridinone - Benzenoid - Pyridinium - Pyridine - Heteroaromatic compound - Organic nitro compound - C-nitro compound - Lactone - Lactam - Carboxylic acid ester - Carboxylic acid derivative - Ether - Oxacycle - Monocarboxylic acid or derivatives - Azacycle - Organoheterocyclic compound - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic nitrogen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic salt - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Alkoxide - Organic cation - 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