Compound Identification
SMILES
[Na+].CCCCCCCCCCCCO[C@H]1O[C@H](CNC(=O)NC2=CC=C(CC([O-])=O)C=C2)[C@@H]2OC(C)(C)O[C@H]12
InChIKey
InChIKey=XDIHGDQXYMSVPN-ZDBLQOHUSA-M
Formula
C29H45N2NaO7
Mass
556.676
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass N-phenylureas
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
N-phenylureas
Intermediate Tree Nodes
Not available
Direct Parent
N-phenylureas
Alternative Parents
Ketals Monosaccharides Oxolanes 1,3-dioxolanes Ureas Carboxylic acid salts Oxacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives Organic oxides Organic sodium salts Hydrocarbon derivatives Organic zwitterions Organonitrogen compounds Carbonyl compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-phenylurea - Ketal - Monosaccharide - Meta-dioxolane - Oxolane - Carboxylic acid salt - Urea - Acetal - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Oxacycle - Organoheterocyclic compound - Organic alkali metal salt - Organooxygen compound - Organonitrogen compound - Organic oxide - Organopnictogen compound - Carbonyl group - Hydrocarbon derivative - Organic nitrogen compound - Organic zwitterion - Organic salt - Organic oxygen compound - Organic sodium salt - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as n-phenylureas. These are compounds containing a N-phenylurea moiety, which is structurally characterized by a phenyl group linked to one nitrogen atom of a urea group.
External Descriptors
Not available