Damnacanthal

COC1=C(C=O)C(O)=CC2=C1C(=O)C3=C(C=CC=C3)C2=O

InChIKey=IPDMWUNUULAXLU-UHFFFAOYSA-N

InChI=1S/C16H10O5/c1-21-16-11(7-17)12(18)6-10-13(16)15(20)9-5-3-2-4-8(9)14(10)19/h2-7,18H,1H3

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Targets

Primary Target	Pharmacology	Potency
Tyrosine-protein kinase Lck 2 Target ID: P06239\|\|\|Q96DW4 Gene ID: 3932.0 Gene Symbol: LCK Target Organism: Homo sapiens (Human) Sources: https://www.ncbi.nlm.nih.gov/pubmed/7547985	Inhibitor 8297	17.0 nM [IC50]
Vascular endothelial growth factor receptor 2 104 Target ID: P35968 Gene ID: 3791.0 Gene Symbol: KDR Target Organism: Homo sapiens (Human) Sources: https://www.ncbi.nlm.nih.gov/pubmed/27816491	Inhibitor 8297
Hepatocyte growth factor receptor 54 Target ID: P08581 Gene ID: 4233.0 Gene Symbol: MET Target Organism: Homo sapiens (Human) Sources: https://www.ncbi.nlm.nih.gov/pubmed/27816491	Inhibitor 8297
Focal adhesion kinase 1 15 Target ID: CHEMBL2695 Sources: https://www.ncbi.nlm.nih.gov/pubmed/27816491	Inhibitor 8297

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:02:46 GMT 2023` Edited by `admin` on `Sat Dec 16 08:02:46 GMT 2023`
Record UNII	WUC3CB63CD
Record Status	`Validated (UNII)`
Record Version

Name

Type

Language

Damnacanthal

Common Name

English

2-Anthraldehyde, 9,10-dihydro-3-hydroxy-1-methoxy-9,10-dioxo-

Systematic Name

English

9,10-Dihydro-3-hydroxy-1-methoxy-9,10-dioxo-2-anthracenecarboxaldehyde

Systematic Name

English

2-ANTHRAQUINONECARBOXALDEHYDE, 3-HYDROXY-1-METHOXY-

Systematic Name

English

3-hydroxy-1-methoxy-9,10-dioxo-9,10-dihydro-2-anthracenecarbaldehyde

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID10197253