Compound Identification
SMILES
CO[C@@H](C(=O)OC[C@]1(O)CCCC2=C1C=CC1=C2C(=O)C(=O)C2=C1OC=C2C)C1=CC=CC=C1
InChIKey
InChIKey=HKHCNKZECINLQF-SHQCIBLASA-N
Formula
C27H24O7
Mass
460.482
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
- Subclass Diterpenoids
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Class
Prenol lipids
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Prenol lipids
Subclass
Diterpenoids
Intermediate Tree Nodes
Not available
Direct Parent
Tanshinones, isotanshinones, and derivatives
Alternative Parents
Phenanthrols Naphthofurans Tetralins Naphthalenes Benzylethers Aryl ketones O-quinones Tertiary alcohols Furans Heteroaromatic compounds Carboxylic acid esters Oxacyclic compounds Dialkyl ethers Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Tanshinone skeleton - Phenanthrol - Phenanthrene - Naphthofuran - Naphthalene - Tetralin - Benzylether - Aryl ketone - O-quinone - Quinone - Benzenoid - Monocyclic benzene moiety - Tertiary alcohol - Heteroaromatic compound - Furan - Carboxylic acid ester - Ketone - Carboxylic acid derivative - Dialkyl ether - Ether - Oxacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Carbonyl group - Alcohol - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as tanshinones, isotanshinones, and derivatives. These are a group of abietane-type norditerpenoid quinones.
External Descriptors
Not available