Compound Identification
SMILES
COC1=C2C(OC3=C2C(=O)C2=C(C3=O)C(O)=C3C[C@H](C)O[C@H](C)C3=C2O)=C2C(=O)[C@]3(O)[C@@H](C)O[C@@H](C)C[C@H]3C(=O)C2=C1
InChIKey
InChIKey=NLDBQRVYLPQMJP-MQNKFPQESA-N
Formula
C31H28O11
Mass
576.554
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
- Class Isochromanequinones
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Isochromanequinones
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Isochromanequinones
Alternative Parents
Naphthopyranones Naphthofurans Naphthoquinones Tetralins 2-benzopyrans Benzofurans Aryl alkyl ketones Quinones Anisoles Pyranones and derivatives Phenols Alkyl aryl ethers Oxanes Vinylogous acids Tertiary alcohols Furans Heteroaromatic compounds Polyols Oxacyclic compounds Dialkyl ethers Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isochromanequinone - Naphthopyranone - Naphthopyran - Naphthofuran - Naphthoquinone - Benzopyran - Isochromane - Naphthalene - 2-benzopyran - Tetralin - Benzofuran - Anisole - Aryl alkyl ketone - Aryl ketone - Quinone - Phenol ether - Alkyl aryl ether - Pyranone - Phenol - Benzenoid - Pyran - Oxane - Tertiary alcohol - Vinylogous acid - Furan - Heteroaromatic compound - Ketone - Organoheterocyclic compound - Ether - Dialkyl ether - Oxacycle - Polyol - Organic oxygen compound - Alcohol - Hydrocarbon derivative - Organooxygen compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as isochromanequinones. These are polycyclic compounds containing an isochromanequinone, which is structurally characterized by a quinone fused to an isochromane, and forming a naphtho[2,3-c]pyran-6,9-dione skeleton.
External Descriptors
Not available