Description
14-Deoxy-12-hydroxyandrographolide is a natural diterpenoid found in the herbs of Andrographis paniculata (Burm. f.) Nees.
Synonyms
12-hydroxy-14-deoxyandrographolide;2(5H)-Furanone, 3-[(1S)-2-[(1R,4aS,5R,6R,8aS)-decahydro-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylene-1-naphthalenyl]-1-hydroxyethyl]-
IUPAC Name
4-[(1S)-2-[(1R,4aS,5R,6R,8aS)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-1-hydroxyethyl]-2H-furan-5-one
Molecular Formula
C20H30O5
Canonical SMILES
CC12CCC(C(C1CCC(=C)C2CC(C3=CCOC3=O)O)(C)CO)O
InChI
InChI=1S/C20H30O5/c1-12-4-5-16-19(2,8-6-17(23)20(16,3)11-21)14(12)10-15(22)13-7-9-25-18(13)24/h7,14-17,21-23H,1,4-6,8-11H2,2-3H3/t14-,15+,16+,17-,19+,20+/m1/s1
InChIKey
KHQNSSJNIXVKMK-XWIHJEQYSA-N