14-Deoxy-11-Hydroxyandrographolide

Catalog	BBC160242091
CAS	160242-09-1
Synonyms	2(5H)-Furanone, 3-[(2R)-2-[(1R,4aS,5R,6R,8aR)-decahydro-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylene-1-naphthalenyl]-2-hydroxyethyl]-
IUPAC Name	4-[(2R)-2-[(1R,4aS,5R,6R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-2-hydroxyethyl]-2H-furan-5-one
Molecular Weight	350.45
Molecular Formula	C20H30O5
Canonical SMILES	C[C@@]12CC[C@H]([C@@]([C@H]1CCC(=C)[C@H]2[C@@H](CC3=CCOC3=O)O)(C)CO)O
InChI	InChI=1S/C20H30O5/c1-12-4-5-15-19(2,8-6-16(23)20(15,3)11-21)17(12)14(22)10-13-7-9-25-18(13)24/h7,14-17,21-23H,1,4-6,8-11H2,2-3H3/t14-,15+,16-,17+,19-,20+/m1/s1
InChI Key	BNLCOXWUZAOLDT-JLEOBMEESA-N
Boiling Point	552.4±50.0 °C
Purity	98%
Density	1.21±0.1 g/ml
Appearance	Solid
pKa	14.28±0.20