Compound Identification
SMILES
CC1=C2NC(=O)C3=C(N=CC=C3)N(C3CC3)C2=NC=C1.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=DMCGRLNUAJEZDF-LEJDKEAZSA-N
Formula
C37H40N4O6
Mass
636.749
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 2,2-dimethyl-1-benzopyrans Alkyldiarylamines Pyridodiazepines 1,4-diazepines Alkyl aryl ethers Pyranones and derivatives Methylpyridines Benzenoids Imidolactams Heteroaromatic compounds Vinylogous amides Lactones Lactams Secondary carboxylic acid amides Secondary alcohols Azacyclic compounds Oxacyclic compounds Hydrocarbon derivatives Organopnictogen compounds Organic oxides
Molecular Framework
Not available
Substituents
Angular pyranocoumarin - Pyranochromene - 2,2-dimethyl-1-benzopyran - Alkyldiarylamine - Pyrido-para-diazepine - Chromane - Benzopyran - 1-benzopyran - Para-diazepine - Alkyl aryl ether - Methylpyridine - Pyranone - Pyran - Pyridine - Imidolactam - Benzenoid - Heteroaromatic compound - Vinylogous amide - Carboxamide group - Lactam - Lactone - Secondary alcohol - Secondary carboxylic acid amide - Ether - Carboxylic acid derivative - Oxacycle - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Alcohol - Organic nitrogen compound - Organic oxide - Organopnictogen 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