Compound Identification
SMILES
CC(N=C(O)CCC1=C(C)C2=C(OC1=O)C=C1OC(C)(C)CCC1=C2)C(O)=O
InChIKey
InChIKey=UULHXXLAXQLMPW-UHFFFAOYSA-N
Formula
C21H25NO6
Mass
387.432
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
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Class
Coumarins and derivatives
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Subclass
Pyranocoumarins
- Level 5 Linear 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
Linear pyranocoumarins
Alternative Parents
Pyranochromenes N-acyl-alpha amino acids 2,2-dimethyl-1-benzopyrans Alanine and derivatives Pyranones and derivatives Alkyl aryl ethers Benzenoids Heteroaromatic compounds Lactones Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Carboximidic acids Carbonyl compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Linear pyranocoumarin - Pyranochromene - N-acyl-alpha-amino acid - N-acyl-alpha amino acid or derivatives - 2,2-dimethyl-1-benzopyran - Alanine or derivatives - Alpha-amino acid or derivatives - Chromane - Benzopyran - 1-benzopyran - Alkyl aryl ether - Pyranone - Benzenoid - Pyran - Heteroaromatic compound - Lactone - Carboximidic acid - Carboximidic acid derivative - Carboxylic acid derivative - Carboxylic acid - Ether - Oxacycle - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Hydrocarbon derivative - Carbonyl group - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as linear pyranocoumarins. These are organic compounds containing a pyran (or a hydrogenated derivative) linearly fused to a coumarin moiety.
External Descriptors
Not available