Compound Identification
SMILES
COC1=C(O)C=CC(\C=C\C(=O)CC(=O)\C=C\C2=CC(OC)=C(OCC(=O)NCCNC(=S)NC3=CC=C(CC(CN(CCN(CC(O)=O)CC(O)=O)CC(O)=O)N(CC(O)=O)CC(O)=O)C=C3)C=C2)=C1
InChIKey
InChIKey=AOUYFDOAKVZOHC-YDWXAUTNSA-N
Formula
C47H56N6O17S
Mass
1009.05
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
-
Class
Diarylheptanoids
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Subclass
Linear diarylheptanoids
- Level 5 Curcuminoids
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Subclass
Linear diarylheptanoids
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Class
Diarylheptanoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Diarylheptanoids
Subclass
Linear diarylheptanoids
Intermediate Tree Nodes
Not available
Direct Parent
Curcuminoids
Alternative Parents
Pentacarboxylic acids and derivatives Hydroxycinnamic acids and derivatives Alpha amino acids Amphetamines and derivatives Methoxyphenols N-phenylthioureas Styrenes Phenoxy compounds Methoxybenzenes Anisoles Alkyl aryl ethers 1-hydroxy-2-unsubstituted benzenoids Aralkylamines Beta-diketones Acryloyl compounds Enones Secondary carboxylic acid amides Thioureas Trialkylamines Ketones Amino acids Carboxylic acids Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Curcumin - Pentacarboxylic acid or derivatives - Hydroxycinnamic acid or derivatives - Cinnamic acid or derivatives - N-phenylthiourea - Methoxyphenol - Alpha-amino acid - Alpha-amino acid or derivatives - Amphetamine or derivatives - Phenoxy compound - Methoxybenzene - Phenol ether - Styrene - Anisole - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - 1,3-diketone - Aralkylamine - Phenol - Benzenoid - 1,3-dicarbonyl compound - Monocyclic benzene moiety - Enone - Acryloyl-group - Alpha,beta-unsaturated ketone - Amino acid - Amino acid or derivatives - Tertiary aliphatic amine - Thiourea - Carboxamide group - Tertiary amine - Secondary carboxylic acid amide - Ketone - Carboxylic acid derivative - Carboxylic acid - Ether - Amine - Carbonyl group - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organic oxide - Organonitrogen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as curcuminoids. These are aromatic compounds containing a curcumin moiety, which is composed of two aryl buten-2-one (feruloyl) chromophores joined by a methylene group.
External Descriptors
Not available