2-(3-tert-Butyl-5-methyl-7-oxofuro[3,2-g]chromen-6-yl)acetic acid

Furocoumarin derivative

Catalog Number EiM08-05216
Alternative Name(s) (3-tert-Butyl-5-methyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)acetic acid
Research Area Drug Discovery Chemistry and Drug Screening
Molecular Formula C18H18O5
CAS# 664366-05-6
Purity 98%
Inchi InChI=1S/C18H18O5/c1-9-10-5-12-13(18(2,3)4)8-22-14(12)7-15(10)23-17(21)11(9)6-16(19)20/h5,7-8H,6H2,1-4H3,(H,19,20)
Inchi Key BTIOCSFNKDFWPF-UHFFFAOYSA-N
SMILES CC1=C(C(=O)OC2=C1C=C3C(=C2)OC=C3C(C)(C)C)CC(=O)O
PubChem Chemical Structure ID 907294
Size from 1 microMole to 1 g
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