Compound Identification
SMILES
OC(=O)[C@@H](CC1=CC(O)=C(O)C=C1)OC(=O)C1=C(C(=O)O[C@H](CC2=CC(O)=C(O)C=C2)C(O)=O)C2=C3C(C=CC(O)=C3OC3=CC(O)=C(O)C=C23)=C1
InChIKey
InChIKey=CMUFBMKEQWQWFP-VSGBNLITSA-N
Formula
C36H26O16
Mass
714.588
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzopyrans
-
Subclass
1-benzopyrans
-
Level 5
Dibenzopyrans
-
Level 6
Xanthenes
- Level 7 Benzoxanthenes
-
Level 6
Xanthenes
-
Level 5
Dibenzopyrans
-
Subclass
1-benzopyrans
-
Class
Benzopyrans
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzopyrans
Subclass
1-benzopyrans
Intermediate Tree Nodes
Dibenzopyrans - Xanthenes
Direct Parent
Benzoxanthenes
Alternative Parents
Naphthalenecarboxylic acids Phenylpropanoic acids Naphthols and derivatives 2-benzopyrans Catechols 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Benzene and substituted derivatives Dicarboxylic acids and derivatives Heteroaromatic compounds Carboxylic acid esters Carboxylic acids Polyols Oxacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoxanthene - 2-naphthalenecarboxylic acid - 2-naphthalenecarboxylic acid or derivatives - 2-naphthol - 3-phenylpropanoic-acid - Naphthalene - 2-benzopyran - Catechol - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Benzenoid - Heteroaromatic compound - Carboxylic acid ester - Carboxylic acid - Carboxylic acid derivative - Polyol - Oxacycle - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzoxanthenes. These are organic compounds containing a benzene ring fused to a xanthene ring system. Xanthene is a tricyclic compound made up of two benzene rings linearly fused to each other through a pyran ring.
External Descriptors
Not available