14-Deoxy-17-Hydroxyandrographolide

Catalog	BBC869384827
CAS	869384-82-7
Synonyms	2(5H)-Furanone, 3-[2-[(1R,2S,4aS,5R,6R,8aS)-decahydro-6-hydroxy-2,5-bis(hydroxymethyl)-5,8a-dimethyl-1-naphthalenyl]ethyl]-
IUPAC Name	4-[2-[(1R,2S,4aS,5R,6R,8aS)-6-hydroxy-2,5-bis(hydroxymethyl)-5,8a-dimethyl-1,2,3,4,4a,6,7,8-octahydronaphthalen-1-yl]ethyl]-2H-furan-5-one
Molecular Weight	352.47
Molecular Formula	C20H32O5
Canonical SMILES	C[C@@]12CC[C@H]([C@@]([C@H]1CC[C@@H]([C@H]2CCC3=CCOC3=O)CO)(C)CO)O
InChI	InChI=1S/C20H32O5/c1-19-9-7-17(23)20(2,12-22)16(19)6-4-14(11-21)15(19)5-3-13-8-10-25-18(13)24/h8,14-17,21-23H,3-7,9-12H2,1-2H3/t14-,15-,16+,17-,19+,20+/m1/s1
InChI Key	LMOGEODVJJLYGW-UQZPWQSVSA-N
Boiling Point	552.1±20.0 °C
Purity	98%
Density	1.148±0.06 g/ml
Appearance	Solid
pKa	14.99±0.10