Compound Identification
SMILES
[O-]S(=O)(=O)C(F)(F)F.CC[C@@]1(OC(=O)CCCN)C(=O)OCC2=C1C=C1N(CC3=CC4=CC=CC=C4[NH+]=C13)C2=O
InChIKey
InChIKey=GYQGJALNHXQAIF-JIDHJSLPSA-N
Formula
C25H24F3N3O8S
Mass
583.54
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
Gamma amino acids and derivatives Pyranopyridines Quinolines and derivatives Trifluoromethanesulfonates Fatty acid esters Pyridinones Pyridinium derivatives Benzenoids Dicarboxylic acids and derivatives Sulfonyls Organosulfonic acids Heteroaromatic compounds Methanesulfonates Carboxylic acid esters Trihalomethanes Lactams Lactones Oxacyclic compounds Azacyclic compounds Alkyl fluorides Organic oxides Hydrocarbon derivatives Organofluorides Carbonyl compounds Monoalkylamines Organic cations
Molecular Framework
Not available
Substituents
Camptothecin - Gamma amino acid or derivatives - Pyranopyridine - Quinoline - Trifluoromethanesulfonate - Fatty acid ester - Pyridinone - Dicarboxylic acid or derivatives - Pyridine - Pyridinium - Benzenoid - Fatty acyl - Heteroaromatic compound - Alkanesulfonic acid - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Methanesulfonate - Amino acid or derivatives - Trihalomethane - Carboxylic acid ester - Lactam - Lactone - Oxacycle - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Hydrocarbon derivative - Halomethane - Organofluoride - Organohalogen compound - Primary aliphatic amine - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxide - Organic oxygen compound - Alkyl fluoride - Primary amine - Alkyl halide - Carbonyl group - Organic nitrogen compound - Amine - 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