Sofalcone

Sofalcone (INN) is an oral gastrointestinal medication used in Japan.^[1] It is a synthetic analog of sophoradin,^[2] a type of natural phenol found in Sophora tonkinensis, an herb used in traditional Chinese medicine.

Sofalcone

Clinical data
AHFS/Drugs.com	International Drug Names
Routes of administration	Oral
ATC code	none
Legal status
Legal status	In general: ℞ (Prescription only)
Identifiers
IUPAC name [5-[(3-Methylbut-2-en-1-yl)oxy]-2-((2E)-3-{4-[(3-methylbut-2-en-1-yl)oxy]phenyl}prop-2-enoyl)phenoxy]acetic acid
CAS Number	153175-87-2 Y
PubChem CID	5282219
ChemSpider	4445402 N
UNII	2B668TJX8E
KEGG	D01956 Y
ChEBI	CHEBI:135732
CompTox Dashboard (EPA)	DTXSID50860797 DTXSID5023586, DTXSID50860797
Chemical and physical data
Formula	C27H30O6
Molar mass	450.531 g·mol−1
3D model (JSmol)	Interactive image
SMILES CC(=CCOC1=CC=C(C=C1)C=CC(=O)C2=C(C=C(C=C2)OCC=C(C)C)OCC(=O)O)C
InChI InChI=1S/C27H30O6/c1-19(2)13-15-31-22-8-5-21(6-9-22)7-12-25(28)24-11-10-23(32-16-14-20(3)4)17-26(24)33-18-27(29)30/h5-14,17H,15-16,18H2,1-4H3,(H,29,30)/b12-7+ N Key:GFWRVVCDTLRWPK-KPKJPENVSA-N N
NY (what is this?)  (verify)