H5006

Hesperidin methyl chalcone

• Synonym(s): (E)-1-[4-[[6-O-(6-Deoxy-α-L-mannopyranosyl)-ß-D-glucopyranosyl]oxy]-2-hydroxy-6-methoxyphenyl]-3-(3-hydroxy-4-methoxyphenyl)-2-propen-1-one
• Empirical Formula (Hill Notation): C₂₉H₃₆O₁₅
• CAS Number: 24292-52-2
• Molecular Weight: 624.59
• EC Number: 246-128-2
• MDL number: MFCD00010438
• UNSPSC Code: 12352100
• PubChem Substance ID: 24895666
• NACRES: NA.22

Properties

• optical activity: [α]20/D −71°, c = 1 in ethanol
• Quality Level: 100
• mp: 120 °C (dec.) (lit.)
• SMILES string: COc1ccc(\C=C\C(=O)c2c(O)cc(O[C@@H]3O[C@H](CO[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)cc2OC)cc1O
• InChI: 1S/C29H36O15/c1-12-22(33)24(35)26(37)28(42-12)41-11-20-23(34)25(36)27(38)29(44-20)43-14-9-17(32)21(19(10-14)40-3)15(30)6-4-13-5-7-18(39-2)16(31)8-13/h4-10,12,20,22-29,31-38H,11H2,1-3H3/b6-4+/t12-,20+,22-,23+,24+,25-,26+,27+,28+,29+/m0/s1
• InChI key: FDHNLHLOJLLXDH-JIYHLSBYSA-N

Description

Application

Involved in pharmacological studies of:

• The effects on adhesion molecules in vascular endothelium
• Thymidine monophosphate kinase inhibitors as antitubercular agents

Safety Information

• Storage Class Code: 11 - Combustible Solids
• WGK: WGK 3
• Flash Point(F): Not applicable
• Flash Point(C): Not applicable
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves