Compound Identification
SMILES
CO[13C](=O)[13C]1=[13CH][13C]2=[13CH][13C]3=[13C](O[13C]4([13CH2][13C]5=[13C](O4)[13C](=O)[13C]4=[13C]([13C]5=O)[13C](O[13CH3])=C[13C](O[13CH3])=[13C]4O)[13CH2][13CH2]3)[13C](O)=[13C]2[13C](=O)O1
InChIKey
InChIKey=FXCBZGHGMRSWJD-GQNGWZJOSA-N
Formula
C27H20O12
Mass
561.254
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzopyrans
-
Subclass
1-benzopyrans
- Level 5 Pyranochromenes
-
Subclass
1-benzopyrans
-
Class
Benzopyrans
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzopyrans
Subclass
1-benzopyrans
Intermediate Tree Nodes
Not available
Direct Parent
Pyranochromenes
Alternative Parents
Naphthofurans Naphthoquinones Isocoumarins and derivatives 2-benzopyrans Quinones Anisoles Aryl ketones Pyranones and derivatives 1-hydroxy-4-unsubstituted benzenoids Alkyl aryl ethers Ketals Vinylogous esters Vinylogous acids Methyl esters Heteroaromatic compounds Dihydrofurans Lactones Oxacyclic compounds Monocarboxylic acids and derivatives Aldehydes Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyranochromene - Naphthofuran - Naphthoquinone - Isocoumarin - Naphthalene - 2-benzopyran - Anisole - Aryl ketone - Quinone - 1-hydroxy-4-unsubstituted benzenoid - Alkyl aryl ether - Ketal - Pyranone - Benzenoid - Pyran - Dihydrofuran - Heteroaromatic compound - Vinylogous ester - Vinylogous acid - Methyl ester - Lactone - Ketone - Carboxylic acid ester - Monocarboxylic acid or derivatives - Ether - Acetal - Carboxylic acid derivative - Oxacycle - Aldehyde - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyranochromenes. These are organic heterocyclic compounds containing a pyran ring fused to a chromene (1-benzopyran) moiety.
External Descriptors
Not available