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Details

Stereochemistry ACHIRAL
Molecular Formula C15H8O7
Molecular Weight 300.2198
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Emodic acid

SMILES

OC(=O)C1=CC(O)=C2C(=O)C3=C(C=C(O)C=C3O)C(=O)C2=C1

InChI

InChIKey=ZJXVNNSMRGTDBI-UHFFFAOYSA-N
InChI=1S/C15H8O7/c16-6-3-8-12(10(18)4-6)14(20)11-7(13(8)19)1-5(15(21)22)2-9(11)17/h1-4,16-18H,(H,21,22)

HIDE SMILES / InChI

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
Target ID: O60674
Gene ID: 3717.0
Gene Symbol: JAK2
Target Organism: Homo sapiens (Human)
15.0 µM [IC50]
PubMed

PubMed

TitleDatePubMed
In silico identification of natural product inhibitors of JAK2.
2015-01
Name Type Language
Emodic acid
Common Name English
2-Anthracenecarboxylic acid, 9,10-dihydro-4,5,7-trihydroxy-9,10-dioxo-
Preferred Name English
9,10-Dihydro-4,5,7-trihydroxy-9,10-dioxo-2-anthracenecarboxylic acid
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID80963942
Created by admin on Mon Mar 31 19:56:05 GMT 2025 , Edited by admin on Mon Mar 31 19:56:05 GMT 2025
PRIMARY
CAS
478-45-5
Created by admin on Mon Mar 31 19:56:05 GMT 2025 , Edited by admin on Mon Mar 31 19:56:05 GMT 2025
PRIMARY
PUBCHEM
361510
Created by admin on Mon Mar 31 19:56:05 GMT 2025 , Edited by admin on Mon Mar 31 19:56:05 GMT 2025
PRIMARY
FDA UNII
EXD4256WVW
Created by admin on Mon Mar 31 19:56:05 GMT 2025 , Edited by admin on Mon Mar 31 19:56:05 GMT 2025
PRIMARY