Compound Identification
SMILES
COC1=CC(C=CC(=O)CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)CO)=CC=C1O
InChIKey
InChIKey=YREGSEDATQYKJP-UHFFFAOYSA-N
Formula
C23H32N2O8S
Mass
496.58
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- 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
Hydroxycinnamic acids and derivatives
Alternative Parents
Beta amino acids and derivatives Methoxyphenols Anisoles Methoxybenzenes Phenoxy compounds Styrenes Alkyl aryl ethers Fatty acyl thioesters 1-hydroxy-2-unsubstituted benzenoids 1,3-dicarbonyl compounds Monosaccharides N-acyl amines Enones Acryloyl compounds Ketones Carbothioic S-esters Thioesters Secondary carboxylic acid amides Secondary alcohols Sulfenyl compounds Organonitrogen compounds Hydrocarbon derivatives Organopnictogen compounds Primary alcohols Organic oxides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Hydroxycinnamic acid or derivatives - Beta amino acid or derivatives - Methoxyphenol - Anisole - Phenoxy compound - Styrene - Methoxybenzene - Phenol ether - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Alkyl aryl ether - Fatty acyl thioester - Benzenoid - 1,3-dicarbonyl compound - Monosaccharide - N-acyl-amine - Fatty acyl - Fatty amide - Monocyclic benzene moiety - Acryloyl-group - Enone - Alpha,beta-unsaturated ketone - Secondary alcohol - Secondary carboxylic acid amide - Carboxamide group - Carbothioic s-ester - Thiocarboxylic acid ester - Ketone - Thiocarboxylic acid or derivatives - Carboxylic acid derivative - Ether - Sulfenyl compound - Organosulfur compound - Alcohol - Primary alcohol - Organooxygen compound - Carbonyl group - Organic oxide - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as hydroxycinnamic acids and derivatives. These are compounds containing an cinnamic acid (or a derivative thereof) where the benzene ring is hydroxylated.
External Descriptors
Not available