Compound Identification
SMILES
CCOC1=CC=C(\C=C2\CCCC3C(N(N=C23)C(=O)C2=CC=CS2)C2=CC=C(OCC)C=C2)C=C1
InChIKey
InChIKey=YBMHHMGLHNIBLN-QOCHGBHMSA-N
Formula
C29H30N2O3S
Mass
486.63
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Diarylheptanoids
- 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
Linear diarylheptanoids
Alternative Parents
Thiophene carboxamides Phenoxy compounds Phenol ethers Alkyl aryl ethers Pyrazolines Heteroaromatic compounds N-alkylated hydrazones Carboxylic acids and derivatives Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Linear 1,7-diphenylheptane skeleton - Phenol ether - Thiophene carboxamide - Thiophene carboxylic acid or derivatives - Phenoxy compound - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Pyrazoline - Thiophene - N-alkylated hydrazone - Organoheterocyclic compound - Azacycle - Ether - Carboxylic acid derivative - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as linear diarylheptanoids. These are diarylheptanoids with an open heptane chain. The two aromatic rings are linked only by the heptane chain.
External Descriptors
Not available