Compound Identification
SMILES
CC1=CC=CC=C1C1=C(O)C(=CC2=C1OC1=C(C3=CC=CC=C3C(O)=C1C1=CC=CC=C1C)C21OC(=O)C2=C(Cl)C=C(C(O)=O)C(Cl)=C12)C1=CN=CC=C1
InChIKey
InChIKey=STNXGPYTJBUXAN-UHFFFAOYSA-N
Formula
C44H27Cl2NO7
Mass
752.6
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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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
Benzoxanthenes Isoflavonoids Phenylnaphthalenes Naphthopyrans P-phthalic acid and derivatives Diarylethers Dichlorobenzoic acids Naphthols and derivatives Halobenzoic acids Benzofuranones Phthalides 3-halobenzoic acids 2-halobenzoic acids Isobenzofurans 1-carboxy-2-haloaromatic compounds Toluenes Phenols Pyrans Aryl chlorides Pyridines and derivatives Vinylogous halides Heteroaromatic compounds Lactones Carboxylic acid esters Oxacyclic compounds Azacyclic compounds Organic oxides Organochlorides Hydrocarbon derivatives Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Linear 1,7-diphenylheptane skeleton - Benzoxanthene - Isoflavonoid - Phenylnaphthalene - Naphthopyran - Xanthene - Dibenzopyran - Para_phthalic_acid - 1-naphthol - 2,5-dichlorobenzoic acid - Diaryl ether - Phthalide - Isobenzofuranone - 2-halobenzoic acid or derivatives - Benzopyran - Naphthalene - Benzofuranone - 1-benzopyran - Halobenzoic acid - 3-halobenzoic acid - 2-halobenzoic acid - Halobenzoic acid or derivatives - 3-halobenzoic acid or derivatives - Isocoumaran - Isobenzofuran - 1-carboxy-2-haloaromatic compound - Toluene - Phenol - Pyran - Pyridine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Vinylogous halide - Carboxylic acid ester - Lactone - Oxacycle - Carboxylic acid derivative - Carboxylic acid - Azacycle - Organoheterocyclic compound - Ether - Organonitrogen compound - Organic oxide - Organooxygen compound - Organochloride - Organohalogen compound - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen 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