CAS Registry Number®
524-12-9
CAS Name
Wedelolactone
Molecular Formula
C16H10O7
Molecular Mass
314.25
Compound Properties
-
Melting Point (1)
327-329 °C (decomp)
Source(s)
- (1) Krishnaswamy, N. R.; Indian Journal of Chemistry, (1966), 4(3), 120-6, CAplus
Other Names and Identifiers
InChI
InChI=1S/C16H10O7/c1-21-6-2-10(19)14-12(3-6)23-16(20)13-7-4-8(17)9(18)5-11(7)22-15(13)14/h2-5,17-19H,1H3
InChIKey
InChIKey=XQDCKJKKMFWXGB-UHFFFAOYSA-N
SMILES
O=C1C2=C(C=3C(O1)=CC(OC)=CC3O)OC=4C2=CC(O)=C(O)C4
Canonical SMILES
O=C1OC2=CC(OC)=CC(O)=C2C=3OC=4C=C(O)C(O)=CC4C13
Other Names for this Substance
- 6H-Benzofuro[3,2-c][1]benzopyran-6-one, 1,8,9-trihydroxy-3-methoxy-
- 1,8,9-Trihydroxy-3-methoxy-6H-benzofuro[3,2-c][1]benzopyran-6-one
- Wedelolactone
- 1,8,9-Trihydroxy-3-methoxy-[1]benzofuro[3,2-c]chromen-6-one
