Compound Identification
SMILES
OC1=C2O[C@H]3C(=O)CC[C@@]4(NC(=O)CSSCC(=O)N[C@@]56CCC(=O)[C@@H]7OC8=C(O)C=CC9=C8[C@]57CCN(CC5CCC5)[C@@H]6C9)[C@H]5CC(C=C1)=C2[C@@]34CCN5CC1CCC1
InChIKey
InChIKey=KDZXAOMQHWOCNV-NIRISHMOSA-N
Formula
C46H54N4O8S2
Mass
855.08
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Phenanthrenes and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Phenanthrenes and derivatives
Alternative Parents
Isoquinolones and derivatives Tetralins Coumarans 1-hydroxy-2-unsubstituted benzenoids Alkyl aryl ethers Aralkylamines Piperidines Ketones Dialkyldisulfides Trialkylamines Secondary carboxylic acid amides Amino acids and derivatives Oxacyclic compounds Azacyclic compounds Sulfenyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenanthrene - Isoquinolone - Tetralin - Coumaran - Alkyl aryl ether - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Aralkylamine - Piperidine - Dialkyldisulfide - Amino acid or derivatives - Carboxamide group - Tertiary aliphatic amine - Ketone - Tertiary amine - Secondary carboxylic acid amide - Organic disulfide - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Carboxylic acid derivative - Ether - Oxacycle - Amine - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenanthrenes and derivatives. These are polycyclic compounds containing a phenanthrene moiety, which is a tricyclic aromatic compound with three non-linearly fused benzene.
External Descriptors
Not available