Compound Identification
SMILES
CCN(CC1=CC(OCC2=CC(OCC3=CC(COC4=CC(COC5=CC(CN(CC)C6=C(C)C=C7C(C)=CC(=O)OC7=C6)=CC(CN(CC)C6=C(C)C=C7C(C)=CC(=O)OC7=C6)=C5)=CC(COC5=CC(CN(CC)C6=C(C)C=C7C(C)=CC(=O)OC7=C6)=CC(CN(CC)C6=C(C)C=C7C(C)=CC(=O)OC7=C6)=C5)=C4)=CC(O)=C3)=CC(COC3=CC(CN(CC)C4=C(C)C=C5C(C)=CC(=O)OC5=C4)=CC(CN(CC)C4=C(C)C=C5C(C)=CC(=O)OC5=C4)=C3)=C2)=CC(CN(CC)C2=C(C)C=C3C(C)=CC(=O)OC3=C2)=C1)C1=C(C)C=C2C(C)=CC(=O)OC2=C1
InChIKey
InChIKey=KSKJIVBHCQCJTG-UHFFFAOYSA-N
Formula
C160H162N8O23
Mass
2565.089
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Coumarins and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Coumarins and derivatives
Alternative Parents
1-benzopyrans Phenylmethylamines Phenoxy compounds Phenol ethers Benzylamines Dialkylarylamines Pyranones and derivatives 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Alkyl aryl ethers Aralkylamines Heteroaromatic compounds Lactones Oxacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Coumarin - 1-benzopyran - Benzopyran - Tertiary aliphatic/aromatic amine - Phenylmethylamine - Dialkylarylamine - Phenol ether - Phenoxy compound - Benzylamine - Pyranone - Aralkylamine - Phenol - Alkyl aryl ether - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Pyran - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Lactone - Tertiary amine - Organoheterocyclic compound - Oxacycle - Ether - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as coumarins and derivatives. These are polycyclic aromatic compounds containing a 1-benzopyran moiety with a ketone group at the C2 carbon atom (1-benzopyran-2-one).
External Descriptors
Not available