Lobetyolin

Datasheet MSDS
Catalog Number
ANC05892
Product Name
Lobetyolin
Structure
Lobetyolin
CAS Number
136085-37-5
IUPAC Name
(2R,3R,4S,5S,6R)-2-[(4E,12E)-1,7-dihydroxytetradeca-4,12-dien-8,10-diyn-6-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
Synonyms
(7E)-2-Hydroxy-1-[(1E)-5-hydroxy-1-penten-1-yl]-7-nonene-3,5-diyn-1-ylb-D-glucopyranoside
Molecular Formula
C20H28O8
Molecular Weight
396.43
Appearance
Powder
Purity
>98%
SMILES
C/C=C/C#CC#CC(C(/C=C/CCCO)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O
InChI
InChI=1S/C20H28O8/c1-2-3-4-5-7-10-14(23)15(11-8-6-9-12-21)27-20-19(26)18(25)17(24)16(13-22)28-20/h2-3,8,11,14-26H,6,9,12-13H2,1H3/b3-2+,11-8+/t14?,15?,16-,17-,18+,19-,20-/m1/s1
InChI Key
MMMUDYVKKPDZHS-UPPVCQNNSA-N
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