Compound Identification
SMILES
CCC1=C(C)C2=CC3=C(C(C)OC)C(C)=C(N3)C=C3N=C([C@@H](CCC(=O)OC)[C@@H]3C)C3=C4N=C(C=C1N2)C(C)=C4C(=O)N(CC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)C3=O
InChIKey
InChIKey=XMOWMVGNCJWVDM-BYGYQDPQSA-N
Formula
C44H43F6N5O5
Mass
835.848
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Tetrapyrroles and derivatives
- Subclass Chlorins
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Class
Tetrapyrroles and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Tetrapyrroles and derivatives
Subclass
Chlorins
Intermediate Tree Nodes
Not available
Direct Parent
Chlorins
Alternative Parents
Trifluoromethylbenzenes Pyrrolopyridines Pyridinones Fatty acid esters Substituted pyrroles Heteroaromatic compounds Methyl esters Lactams Monocarboxylic acids and derivatives Azacyclic compounds Dialkyl ethers Hydrocarbon derivatives Alkyl fluorides Organonitrogen compounds Carbonyl compounds Organic oxides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Chlorin - Trifluoromethylbenzene - Pyrrolopyridine - Fatty acid ester - Pyridinone - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Substituted pyrrole - Pyridine - Heteroaromatic compound - Methyl ester - Pyrrole - Carboxylic acid ester - Lactam - Carboxylic acid derivative - Dialkyl ether - Ether - Azacycle - Monocarboxylic acid or derivatives - Organic nitrogen compound - Hydrocarbon derivative - Alkyl halide - Organic oxide - Organic oxygen compound - Alkyl fluoride - Carbonyl group - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as chlorins. These are large heterocyclic aromatic ring systems consisting, at the core, of three pyrroles and one pyrroline coupled through four methine linkages.
External Descriptors
Not available