Compound Identification
SMILES
CC1=COC2=C1C(=O)C(=O)C1=C2C=CC2=C1CC[C@@H](O)[C@@]2(C)O
InChIKey
InChIKey=RTKDBIDPGKCZJS-XIKOKIGWSA-N
Formula
C18H16O5
Mass
312.321
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 O-quinones Aryl ketones Tertiary alcohols Heteroaromatic compounds Furans Secondary alcohols 1,2-diols Oxacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Tanshinone skeleton - Phenanthrol - Phenanthrene - Naphthofuran - Naphthalene - Tetralin - O-quinone - Aryl ketone - Quinone - Benzenoid - Furan - Heteroaromatic compound - Tertiary alcohol - 1,2-diol - Ketone - Secondary alcohol - Oxacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxide - Alcohol - Organic oxygen compound - 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