Description
Nemoralisin C is a nemoralisin diterpenoids isolated from Aphanamixis polystachya (Wall.) R. Parker.
Synonyms
(6S)-6-[(1E,6S)-6-(4,5-Dihydro-5,5-dimethyl-4-oxo-2-furanyl)-6-hydroxy-2-methyl-1-hepten-1-yl]-5,6-dihydro-4-methyl-2H-pyran-2-one
IUPAC Name
(2S)-2-[(E,6S)-6-(5,5-dimethyl-4-oxofuran-2-yl)-6-hydroxy-2-methylhept-1-enyl]-4-methyl-2,3-dihydropyran-6-one
Molecular Formula
C20H28O5
Canonical SMILES
CC1=CC(=O)OC(C1)C=C(C)CCCC(C)(C2=CC(=O)C(O2)(C)C)O
InChI
InChI=1S/C20H28O5/c1-13(9-15-10-14(2)11-18(22)24-15)7-6-8-20(5,23)17-12-16(21)19(3,4)25-17/h9,11-12,15,23H,6-8,10H2,1-5H3/b13-9+/t15-,20+/m1/s1
InChIKey
BNEONHJMPXMLIV-TWSSUNLLSA-N
Boiling Point
550.2±50.0 °C(Predicted)
Density
1.166±0.06 g/cm3(Predicted)
pKa
15.12±0.29(Predicted)