Compound Identification
SMILES
CCC[C@@]1(CCC2=CC=CC=C2)CC(=O)C(\C(=C\C)C2=CC(=CC=C2)[N+]([O-])=O)C(=O)O1
InChIKey
InChIKey=QJDIYGJVUJTACB-YGNIGKCSSA-N
Formula
C25H27NO5
Mass
421.493
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
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Class
Diarylheptanoids
- Subclass Linear diarylheptanoids
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Class
Diarylheptanoids
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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
Nitrobenzenes Styrenes Nitroaromatic compounds Delta valerolactones Oxanes 1,3-dicarbonyl compounds Carboxylic acid esters Cyclic ketones Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Organic oxoazanium compounds Monocarboxylic acids and derivatives Organonitrogen compounds Hydrocarbon derivatives Organic oxides Organic salts Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Linear 1,7-diphenylheptane skeleton - Nitrobenzene - Nitroaromatic compound - Styrene - Delta valerolactone - Delta_valerolactone - Monocyclic benzene moiety - Oxane - 1,3-dicarbonyl compound - Benzenoid - Carboxylic acid ester - Ketone - Lactone - C-nitro compound - Organic nitro compound - Cyclic ketone - Organoheterocyclic compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic oxoazanium - Oxacycle - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic nitrogen compound - Organic salt - Organic oxygen compound - Organic cation - Aromatic heteromonocyclic 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