CAS 7380-40-7 Bergamottin - Analytical Products / Alfa Chemistry

CAT	APS7380407
CAS	7380-40-7
Structure
MDL Number	MFCD00017409
Synonyms	5-Geranoxypsoralen, Bergaptin, 7H-Furo[3,2-g][1]benzopyran-7-one, 4-[[(2E)-3,7-dimethyl-2,6-octadienyl]oxy]- (9CI), 4-[[(2E)-3,7-Dimethyl-2,6-octadien-1-yl]oxy]-7H-furo[3,2-g][1]benzopyran-7-one, 7H-Furo[3,2-g][1]benzopyran-7-one, 4-[(3,7-dimethyl-2,6-octadienyl)oxy]-, (E)- (8CI), Bergamottin (6CI),4-[[(2E)-3,7-Dimethyl-2,6-octadien-1-yl]oxy]-7H-Furo[3,2-g][1]benzopyran-7-one, Bergamotine
IUPAC Name	4-[(2E)-3,7-dimethylocta-2,6-dienoxy]furo[3,2-g]chromen-7-one
Molecular Weight	338.40
Molecular Formula	C21H22O4
Canonical SMILES	CC(=CCC\C(=C\COc1c2C=CC(=O)Oc2cc3occc13)\C)C
InChI	InChI=1S/C21H22O4/c1-14(2)5-4-6-15(3)9-11-24-21-16-7-8-20(22)25-19(16)13-18-17(21)10-12-23-18/h5,7-10,12-13H,4,6,11H2,1-3H3/b15-9+
InChI Key	DBMJZOMNXBSRED-OQLLNIDSSA-N
REAXYS Number	1353914

Description	analytical standard
Accurate Mass	338.1518
Assay	≥98.0% (HPLC)
Format	Neat
Grade	analytical standard
MP	75-80 °C
Shipping	Room Temperature
Size	10MG
Storage Conditions	-20°C Freezer
Subcategory	Additional phytochemical reference materials