genipin-1-b-D-gentiobioside

Datasheet MSDS
Catalog Number
ANC02911
Product Name
genipin-1-b-D-gentiobioside
CAS Number
29307-60-6
IUPAC Name
methyl (1S,4aS,7aS)-7-(hydroxymethyl)-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylate
Synonyms
genipin1-gentiobioside; Genipin-1-b-D-gentiobioside; Genipin-1-β-D-gentiobioside; Genipin1-O-beta-D-gentiobioside; Cyclopenta[c]pyran-4-carboxylicacid,1-[(6-O-b-D-glucopyranosyl-b-D-glucopyranosyl)oxy]-1,4a,5,7a-tetrahydro-7-(hydroxyMethyl)-,Methylester,(1S,4aS,7aS)-; Genipin-1-O-gentiobioside
Molecular Formula
C23H34O15
Molecular Weight
550.51
Appearance
White powder
Purity
>98%
Density
1.63±0.1g/cm3
SMILES
COC(=O)C1=CO[C@H]([C@H]2[C@@H]1CC=C2CO)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)O)O
InChI
InChI=1S/C23H34O15/c1-33-20(32)10-6-34-21(13-8(4-24)2-3-9(10)13)38-23-19(31)17(29)15(27)12(37-23)7-35-22-18(30)16(28)14(26)11(5-25)36-22/h2,6,9,11-19,21-31H,3-5,7H2,1H3/t9-,11-,12-,13-,14-,15-,16+,17+,18-,19-,21+,22-,23+/m1/s1
InChI Key
FYZYXYLPBWLLGI-AUOPOVQUSA-N
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