Structure Information
Structure

Compound Identification

SMILES

CCCCCCCCCCOC1=CC=C(CC(CNC2=NC(Cl)=NC(N)=N2)(COC2=NC(N)=NC(NCC(COC3=NC(=NC(N)=N3)N3CCOCC3)(CC3=CC=C(OCCCCCCCCCC)C=C3)CC3=CC=C(OCCCCCCCCCC)C=C3)=N2)CC2=CC=C(OCCCCCCCCCC)C=C2)C=C1

InChIKey

InChIKey=JPJBFTRWYDXPEM-UHFFFAOYSA-N

Formula

C87H132ClN15O7

Mass

1535.56

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Linear 1,3-diarylpropanoids

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Linear 1,3-diarylpropanoids

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Linear 1,3-diarylpropanoid - Phenoxy compound - 2,4-diamine-s-triazine - Alkoxy-s-triazine - Phenol ether - Dialkylarylamine - Alkyl aryl ether - Chloro-s-triazine - Halo-s-triazine - Amino-1,3,5-triazine - Aminotriazine - N-aliphatic s-triazine - 1,3,5-triazine - Morpholine - Benzenoid - Monocyclic benzene moiety - Aryl halide - Triazine - Oxazinane - Aryl chloride - Heteroaromatic compound - Organoheterocyclic compound - Ether - Dialkyl ether - Azacycle - Oxacycle - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Amine - Primary amine - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as linear 1,3-diarylpropanoids. These are organic compounds with a structure based on a C6-C3-C6 skeleton, where the two benzene rings are not linked together.

External Descriptors

Not available

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