Compound Identification
SMILES
COC1=C(O)C=CC(=C1)C(C)=O.O[C@H]1CO[C@@H]2[C@@H](CO[C@H]12)O[N+]([O-])=O
InChIKey
InChIKey=MUMGMPKTWCXJLQ-SSPAHAAFSA-N
Formula
C15H19NO9
Mass
357.315
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbonyl compounds
-
Level 5
Ketones
-
Level 6
Aryl ketones
-
Level 7
Phenylketones
- Level 8 Alkyl-phenylketones
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Level 7
Phenylketones
-
Level 6
Aryl ketones
-
Level 5
Ketones
-
Subclass
Carbonyl compounds
-
Class
Organooxygen compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Carbonyl compounds
Intermediate Tree Nodes
Ketones - Aryl ketones - Phenylketones
Direct Parent
Alkyl-phenylketones
Alternative Parents
Isosorbides Methoxyphenols Acetophenones Anisoles Aryl alkyl ketones Benzoyl derivatives Phenoxy compounds Methoxybenzenes Alkyl aryl ethers 1-hydroxy-2-unsubstituted benzenoids Oxolanes Alkyl nitrates Organic nitro compounds Organic nitric acids and derivatives Secondary alcohols Dialkyl ethers Oxacyclic compounds Hydrocarbon derivatives Aldehydes Organic nitrogen compounds Organic oxides Organic salts Organic zwitterions
Molecular Framework
Not available
Substituents
Alkyl-phenylketone - Isosorbide - Methoxyphenol - Acetophenone - Phenoxy compound - Anisole - Benzoyl - Methoxybenzene - Furofuran - Aryl alkyl ketone - Phenol ether - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Phenol - Monocyclic benzene moiety - Benzenoid - Oxolane - Organic nitrate - Alkyl nitrate - Organic nitro compound - Organic nitric acid or derivatives - Secondary alcohol - Allyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Ether - Dialkyl ether - Oxacycle - Organic salt - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Alcohol - Organic zwitterion - Aldehyde - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group.
External Descriptors
Not available