PHL80631

1,3,6-Trigalloyl β-D-glucose

phyproof^® Reference Substance

• Synonym(s): 1,3,6-Tri-O-galloyl-β-D-glucose, β-D-Glucopyranose 1,3,6-trigallate, β-D-Glucopyranose-1,3,6-tris(3,4,5-trihydroxybenzoate), 1,3,6-Tri-O-galloyl-β-D-glucopyranose, NP 005114, NSC 69861
• Empirical Formula (Hill Notation): C₂₇H₂₄O₁₈
• CAS Number: 18483-17-5
• Molecular Weight: 636.47
• NACRES: NA.24
• UNSPSC Code: 41116107
• MDL number: MFCD06656305
• Beilstein/REAXYS Number: 76215

Properties

• grade: primary reference standard
• product line: phyproof^® Reference Substance
• assay: ≥90.0% (HPLC)
• form: powder
• manufacturer/tradename: PhytoLab
• storage temp.: 2-8°C
• SMILES string: O1[C@H]([C@@H]([C@H]([C@@H]([C@H]1COC(=O)c4cc(c(c(c4)O)O)O)O)OC(=O)c3cc(c(c(c3)O)O)O)O)OC(=O)c2cc(c(c(c2)O)O)O
• InChI: 1S/C27H24O18/c28-11-1-8(2-12(29)18(11)34)24(39)42-7-17-21(37)23(44-25(40)9-3-13(30)19(35)14(31)4-9)22(38)27(43-17)45-26(41)10-5-15(32)20(36)16(33)6-10/h1-6,17,21-23,27-38H,7H2/t17-,21-,22-,23+,27+/m1/s1
• InChI key: RNKMOGIPOMVCHO-SJMVAQJGSA-N

Description

General description

This substance is supplied with certified chromatographic purity. The exact value can be found on the certificate. Produced by PhytoLab GmbH & Co. KG

Legal Information

phyproof is a registered trademark of PhytoLab GmbH & Co. KG

Safety Information

• pictograms: GHS07
• signalword: Warning
• hcodes: H315,H319,H335
• pcodes: P261 - P264 - P271 - P280 - P302 + P352 - P305 + P351 + P338
• Hazard Classifications: Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
• target_organs: Respiratory system
• Storage Class: 11 - Combustible Solids
• wgk: WGK 3
• flash_point_f: Not applicable
• flash_point_c: Not applicable