Compound Identification
SMILES
COC1=C(OC)C=C(C=CC(=O)OC2=CC3=C4N(C(=O)C3=O)C(C)(C)C=C(C)C4=C2)C=C1
InChIKey
InChIKey=NTRLNTXFAYJAQN-UHFFFAOYSA-N
Formula
C25H23NO6
Mass
433.46
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Cinnamic acids and derivatives
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Subclass
Hydroxycinnamic acids and derivatives
- Level 5 Coumaric acids and derivatives
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Subclass
Hydroxycinnamic acids and derivatives
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Class
Cinnamic acids and derivatives
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Cinnamic acids and derivatives
Subclass
Hydroxycinnamic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Coumaric acids and derivatives
Alternative Parents
Cinnamic acid esters Hydroquinolones Dimethoxybenzenes Hydroquinolines Phenol esters Indoles and derivatives Anisoles Aryl ketones Phenoxy compounds Styrenes Fatty acid esters Alkyl aryl ethers Tertiary carboxylic acid amides Enoate esters Vinylogous amides Lactams Monocarboxylic acids and derivatives Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Coumaric acid or derivatives - Cinnamic acid ester - Dihydroquinolone - Dihydroquinoline - O-dimethoxybenzene - Dimethoxybenzene - Phenol ester - Indole or derivatives - Anisole - Phenoxy compound - Methoxybenzene - Phenol ether - Styrene - Aryl ketone - Alkyl aryl ether - Fatty acid ester - Benzenoid - Fatty acyl - Monocyclic benzene moiety - Tertiary carboxylic acid amide - Vinylogous amide - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Lactam - Ketone - Carboxamide group - Carboxylic acid ester - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Azacycle - Carboxylic acid derivative - Ether - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Carbonyl group - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as coumaric acids and derivatives. These are aromatic compounds containing Aromatic compounds containing a cinnamic acid moiety (or a derivative thereof) hydroxylated at the C2 (ortho-), C3 (meta-), or C4 (para-) carbon atom of the benzene ring.
External Descriptors
Not available