| CAS Number | 102130-43-8 |
| Catalog Number | AG008SKF(AGN-PC-0OR964) |
| Chemical Name | Atractyloside dipotassium salt |
| IUPAC Name | dipotassium;[(2S,3R,4R,5R,6R)-2-[[(1R,4R,5R,7R,9R,10S,13R,15S)-5-carboxy-15-hydroxy-9-methyl-14-methylidene-7-tetracyclo[11.2.1.01,10.04,9]hexadecanyl]oxy]-6-(hydroxymethyl)-3-(3-methylbutanoyloxy)-5-sulfonatooxyoxan-4-yl] sulfate |
| InChI | InChI=1S/C30H46O16S2.2K/c1-14(2)9-22(32)44-25-24(46-48(39,40)41)23(45-47(36,37)38)20(13-31)43-28(25)42-17-10-18(27(34)35)19-7-8-30-11-16(15(3)26(30)33)5-6-21(30)29(19,4)12-17;;/h14,16-21,23-26,28,31,33H,3,5-13H2,1-2,4H3,(H,34,35)(H,36,37,38)(H,39,40,41);;/q;2*+1/p-2/t16-,17-,18-,19-,20-,21+,23-,24+,25-,26+,28+,29-,30-;;/m1../s1 |
| InChI Key | IUCNQFHEWLYECJ-VCQILIGCSA-L |
| MDL Number | MFCD00078810 |
| Molecular Formula | C30H46K2O16S2 |
| Molecular Weight | 805.0032 |
| SMILES | O[C@@H]1[C@]23[C@](CC[C@](C1=C)([H])C3)([H])[C@]4([C@](C(C[C@H](C4)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)OS(=O)(O)=O)OS(=O)(O)=O)OC(CC(C)C)=O)C(O)=O)([H])CC2)C.[K].[K] |
| Synonyms | Atractyloside potassium salt,
Atractyloside Dipotassium Salt,
102130-43-8,
C30H44K2O16S2,
HMS2097C16,
MFCD00078810,
X6830,
C-56192,
Q-100027,
ACN-046940,
A8188,
19-Norkaur-16-en-18-oic acid, 15-hydroxy-2-[[2-O-(3-methyl-1-oxobutyl)-3,4-di-O-sulfo-.beta.-D-glucopyranosyl]oxy]-, dipotassium salt, (2.beta.,15.alpha.)-,
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