Description
Danshenxinkun A is a natural diterpenoid isolated from the roots of Salvia miltiorrhiza Bge.
Synonyms
2-(1-Methyl-2-hydroxyethyl)-3-hydroxy-8-methylphenanthrene-1,4-dione; 3-Hydroxy-2-(1-hydroxypropan-2-yl)-8-methylphenanthrene-1,4-dione.
IUPAC Name
1-hydroxy-2-(1-hydroxypropan-2-yl)-8-methylphenanthrene-3,4-dione
Molecular Formula
C18H16O4
Canonical SMILES
CC1=C2C=CC3=C(C2=CC=C1)C(=O)C(=O)C(=C3O)C(C)CO
InChI
InChI=1S/C18H16O4/c1-9-4-3-5-12-11(9)6-7-13-15(12)18(22)17(21)14(16(13)20)10(2)8-19/h3-7,10,19-20H,8H2,1-2H3
InChIKey
GRGPQNRHXNRJFL-UHFFFAOYSA-N