Compound Identification
SMILES
CC1=CN([C@@H]2O[C@H](CO)C=C2)C(=O)NC1=O.CCCC1=CC(=O)OC2=C1C1=C(C=CC(C)(C)O1)C1=C2[C@@H](O)[C@H](C)[C@@H](C)O1
InChIKey
InChIKey=BTSXEEUZFHCWCC-KEFCLNKOSA-N
Formula
C32H38N2O9
Mass
594.661
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
-
Class
Coumarins and derivatives
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Subclass
Pyranocoumarins
- Level 5 Angular pyranocoumarins
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Subclass
Pyranocoumarins
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Class
Coumarins and derivatives
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Coumarins and derivatives
Subclass
Pyranocoumarins
Intermediate Tree Nodes
Not available
Direct Parent
Angular pyranocoumarins
Alternative Parents
Pyranochromenes Nucleoside and nucleotide analogues 2,2-dimethyl-1-benzopyrans Alkyl aryl ethers Pyrimidones Pyranones and derivatives Benzenoids Hydropyrimidines Vinylogous amides Dihydrofurans Heteroaromatic compounds Lactones Lactams Ureas Secondary alcohols Oxacyclic compounds Azacyclic compounds Primary alcohols Hydrocarbon derivatives Organic oxides Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Not available
Substituents
Angular pyranocoumarin - Pyranochromene - 2,2-dimethyl-1-benzopyran - Chromane - Benzopyran - 1-benzopyran - Alkyl aryl ether - Pyranone - Pyrimidone - Hydropyrimidine - Pyran - Pyrimidine - Benzenoid - Dihydrofuran - Heteroaromatic compound - Vinylogous amide - Lactam - Lactone - Urea - Secondary alcohol - Oxacycle - Ether - Azacycle - Organoheterocyclic compound - Primary alcohol - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Alcohol - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as angular pyranocoumarins. These are organic compounds containing a pyran (or a hydrogenated derivative) angularly fused to a coumarin moiety.
External Descriptors
Not available