Compound Identification
SMILES
CC1=CC(=O)CC(C)(C)C1(O)C1=C(C=CO1)C(O)=O
InChIKey
InChIKey=NDOXLLFBUTYPSI-UHFFFAOYSA-N
Formula
C14H16O5
Mass
264.277
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Furans
-
Subclass
Furoic acid and derivatives
- Level 5 Furoic acids
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Subclass
Furoic acid and derivatives
-
Class
Furans
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Furans
Subclass
Furoic acid and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Furoic acids
Alternative Parents
Furan-3-carboxylic acids Cyclohexenones Tertiary alcohols Heteroaromatic compounds Oxacyclic compounds Carboxylic acids Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Furan-3-carboxylic acid - Furan-3-carboxylic acid or derivatives - Furoic acid - Cyclohexenone - Tertiary alcohol - Heteroaromatic compound - Ketone - Cyclic ketone - Carboxylic acid - Carboxylic acid derivative - Oxacycle - Organic oxide - Organooxygen compound - Alcohol - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as furoic acids. These are organic compounds containing a furoic acid moiety, with a structure characterized by a furan ring bearing a carboxylic acid group at the C2 or C3 carbon atom.
External Descriptors
Not available