The Aucubin, with the CAS registry number 479-98-1, is also known as β-D-Glucopyranoside,(1S,4aR,5S,7aS)-1,4a,5,7a-tetrahydro-5-hydroxy-7-(hydroxymethyl)cyclopenta[c]pyran-1-yl. It belongs to the product categories of Iridoids; Natural Terpene Standards Chemical Class; Other Chemical Class; Oxygen containing Chemical Class; Alcohols; Alphabetic; AR to AZ Chromatography; Heterocyclics; Life Sciences Standards; Natural Compounds; Natural Compounds Chemical Class; Cytokine signaling. Its EINECS number is 207-540-8. This chemical's molecular formula is C₁₅H₂₂O₉and molecular weight is 346.33. What's more, its IUPAC name is (2S,3R,4S,5S,6R)-2-[-(1S,4aR,5S,7aS-5-hydroxy-7-(hydroxymethyl-1,4a,5,7a-tetrahydrocyclopenta-[c]-pyran-1-yl]-oxy]-6-(hydroxymethyl)-oxane-3,4,5-triol. It should be sealed and stored in a ventilated and dry place. Moreover, it should be protected from oxides. Aucubin is an iridoid glycoside. It is found in plants used in traditional Chinese and folk medicine. It was found to protect against liver damage induced by carbon tetrachloride or alpha-amanitin in mice and rats when 80 mg/kg was dosed intraperitoneally. This chemical is used in biochemical research.

Physical properties of Aucubin are: (1)ACD/LogP: -4.103; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): -4.10; (4)ACD/LogD (pH 7.4): -4.10; (5)ACD/BCF (pH 5.5): 1.00; (6)ACD/BCF (pH 7.4): 1.00; (7)ACD/KOC (pH 5.5): 1.00; (8)ACD/KOC (pH 7.4): 1.00; (9)#H bond acceptors: 9; (10)#H bond donors: 6; (11)#Freely Rotating Bonds: 10; (12)Polar Surface Area: 149.07 Å²; (13)Index of Refraction: 1.66; (14)Molar Refractivity: 79.201 cm³; (15)Molar Volume: 214.644 cm³; (16)Polarizability: 31.398×10^-24cm³; (17)Surface Tension: 88.64 dyne/cm; (18)Density: 1.614 g/cm³; (19)Flash Point: 358.414 °C; (20)Enthalpy of Vaporization: 112.525 kJ/mol; (21)Boiling Point: 669.025 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical is harmful if swallowed. You should not breathe dust. In case of accident or if you feel unwell, you need to seek medical advice immediately (show the label where possible).

You can still convert the following datas into molecular structure:
(1)SMILES: O2\C=C/[C@@H]1[C@@H](C(=C/[C@H]1O)\CO)[C@@H]2O[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)CO
(2)Std. InChI: InChI=1S/C15H22O9/c16-4-6-3-8(18)7-1-2-22-14(10(6)7)24-15-13(21)12(20)11(19)9(5-17)23-15/h1-3,7-21H,4-5H2/t7-,8+,9+,10+,11+,12-,13+,14-,15-/m0/s1
(3)Std. InChIKey: RJWJHRPNHPHBRN-FKVJWERZSA-N