Compound Identification
SMILES
COC1=C(NC(=O)NC2=CC=C(OCCN3CC(C)OC(C)C3)C3=CC=CC=C23)C=C(C=C1\C=C\C(=O)N1CCOCC1)C(C)(C)C
InChIKey
InChIKey=IIRNQSYDULTBBD-SDNWHVSQSA-N
Formula
C37H48N4O6
Mass
644.813
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Cinnamic acids and derivatives
-
Subclass
Hydroxycinnamic acids and derivatives
- Level 5 Coumaric acids and derivatives
-
Subclass
Hydroxycinnamic acids and derivatives
-
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
N-phenylureas Naphthalenes Methoxyanilines Phenylpropanes Anisoles Methoxybenzenes Phenoxy compounds Styrenes Alkyl aryl ethers Morpholines Tertiary carboxylic acid amides Trialkylamines Amino acids and derivatives Ureas Dialkyl ethers Oxacyclic compounds Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Coumaric acid or derivatives - N-phenylurea - Naphthalene - Phenylpropane - Methoxyaniline - Anisole - Methoxybenzene - Styrene - Phenol ether - Phenoxy compound - Alkyl aryl ether - Monocyclic benzene moiety - Morpholine - Benzenoid - Oxazinane - Tertiary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Urea - Tertiary aliphatic amine - Tertiary amine - Oxacycle - Azacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Organoheterocyclic compound - Organic nitrogen compound - Hydrocarbon derivative - Amine - Carbonyl group - Organopnictogen compound - Organic oxide - Organooxygen compound - Organic oxygen compound - 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