Details of the Drug

General Information of Drug (ID: DMS2V2H)

Drug Name
esculetin
Synonyms aesculetin; 6,7-dihydroxycoumarin; cichorigenin
Indication
Disease Entry ICD 11 Status REF
Discovery agent N.A. Investigative [1]
Drug Type
Small molecular drug
Structure
3D MOL is unavailable 2D MOL
Chemical Identifiers
Formula
C9H6O4
Canonical SMILES
C1=CC(=O)OC2=CC(=C(C=C21)O)O
InChI
1S/C9H6O4/c10-6-3-5-1-2-9(12)13-8(5)4-7(6)11/h1-4,10-11H
InChIKey
ILEDWLMCKZNDJK-UHFFFAOYSA-N
Cross-matching ID
PubChem CID
5281416
ChEBI ID
CHEBI:490095
CAS Number
305-01-1
TTD ID
D0YZ5G

References

1 URL: http://www.guidetopharmacology.org Nucleic Acids Res. 2015 Oct 12. pii: gkv1037. The IUPHAR/BPS Guide to PHARMACOLOGY in 2016: towards curated quantitative interactions between 1300 protein targets and 6000 ligands. (Ligand id: 5180).