Compound Identification
SMILES
COC1=CC=CC2=C1C(OC(C)=O)=C1[C@H](C)O[C@@H]3CC(=O)O[C@@H]3C1=C2OC(C)=O
InChIKey
InChIKey=HBCRLPAXNSXAQX-CGUBMOHASA-N
Formula
C21H20O8
Mass
400.383
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Naphthopyrans
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Naphthopyrans
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Naphthopyrans
Alternative Parents
Naphthalenes 2-benzopyrans Tricarboxylic acids and derivatives Anisoles Alkyl aryl ethers Pyrans Gamma butyrolactones Tetrahydrofurans Carboxylic acid esters Oxacyclic compounds Dialkyl ethers Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Naphthopyran - Benzopyran - Isochromane - Naphthalene - 2-benzopyran - Tricarboxylic acid or derivatives - Anisole - Alkyl aryl ether - Pyran - Benzenoid - Gamma butyrolactone - Tetrahydrofuran - Carboxylic acid ester - Lactone - Oxacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as naphthopyrans. These are compounds containing a pyran ring fused to a naphthalene moiety. Furan is a 6 membered-ring non-aromatic ring with five carbon and one oxygen atoms. Naphthalene is a polycyclic aromatic hydrocarbon made up of two fused benzene rings.
External Descriptors
Not available