2-Epi-3A-Epiburchellin

Catalog	BBC57457995
CAS	57457-99-5
Synonyms	(2R,3S,3aS)-2-(1,3-Benzodioxol-5-yl)-3,3a-dihydro-5-methoxy-3-methyl-3a-(2-propen-1-yl)-6(2H)-benzofuranone
IUPAC Name	(2R,3S,3aS)-2-(1,3-benzodioxol-5-yl)-5-methoxy-3-methyl-3a-prop-2-enyl-2,3-dihydro-1-benzofuran-6-one
Molecular Weight	340.37
Molecular Formula	C20H20O5
Canonical SMILES	C[C@@H]1[C@@H](OC2=CC(=O)C(=C[C@]12CC=C)OC)C3=CC4=C(C=C3)OCO4
InChI	InChI=1S/C20H20O5/c1-4-7-20-10-17(22-3)14(21)9-18(20)25-19(12(20)2)13-5-6-15-16(8-13)24-11-23-15/h4-6,8-10,12,19H,1,7,11H2,2-3H3/t12-,19-,20-/m1/s1
InChI Key	SOLJFAQVSWXZEQ-TVNIXMEMSA-N
Boiling Point	491.0±45.0 °C
Purity	98%
Density	1.27±0.1 g/ml
Appearance	Solid