107870-05-3

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107870-05-3 Structure

Identification	Back Directory
[Name] Quivin
[CAS] 107870-05-3
[Synonyms] Quivin Cinchonaglycoside A Cinchonaglycoside A >=95% (LC/MS-ELSD) Urs-12-ene-27,28-dioic acid, 3-[(6-deoxy-β-D-glucopyranosyl)oxy]-, (3β)-
[Molecular Formula] C36H56O9
[MDL Number] MFCD17214828
[MOL File] 107870-05-3.mol
[Molecular Weight] 632.84

Chemical Properties	Back Directory
[Melting point ] 237-238 °C
[Boiling point ] 753.3±60.0 °C(Predicted)
[density ] 1.27±0.1 g/cm3(Predicted)
[storage temp. ] -20°C
[form ] solid
[pka] 4.25±0.70(Predicted)
[Major Application] metabolomics vitamins, nutraceuticals, and natural products
[InChIKey] PUOQHFWXBKTHST-DLCGLXBKSA-N
[SMILES] C[C@@H]1CC[C@@]2(CC[C@]3(C(O)=O)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](C)[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C)C(O)=O

Safety Data	Back Directory
[Hazard statements ] H413
[WGK Germany ] 3
[Storage Class] 11 - Combustible Solids
[Hazard Classifications] Aquatic Chronic 4

Hazard Information	Back Directory
[Uses] metabolomics vitamins, nutraceuticals, and natural products

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