10-Hydroxymajoroside

CAS	259753-12-3
Synonyms	Cyclopenta[c]pyran-4-carboxylic acid, 1-(β-D-glucopyranosyloxy)-1,4a,5,6-tetrahydro-6-hydroxy-7-(hydroxymethyl)-, methyl ester, (1S,4aS,6S)-
IUPAC Name	methyl (1S,4aS,6S)-6-hydroxy-7-(hydroxymethyl)-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,6-tetrahydrocyclopenta[c]pyran-4-carboxylate
Molecular Weight	404.37
Molecular Formula	C17H24O11
Canonical SMILES	COC(=O)C1=CO[C@H](C2=C([C@H](C[C@H]12)O)CO)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O
InChI	InChI=1S/C17H24O11/c1-25-15(24)8-5-26-16(11-6(8)2-9(20)7(11)3-18)28-17-14(23)13(22)12(21)10(4-19)27-17/h5-6,9-10,12-14,16-23H,2-4H2,1H3/t6-,9+,10-,12-,13+,14-,16+,17+/m1/s1
InChI Key	IWDXNCIWSRAIAR-OCGKWZSUSA-N
Boiling Point	700.3±60.0 °C
Purity	98%
Density	1.62±0.1 g/ml
pKa	12.79±0.70
Appearance	Solid