Glucoraphanin

CAS: 21414-41-5

Ref. TR-G450250

Product Information

• Name: Glucoraphanin
• Synonyms: ß-D-Glucopyranose, 1-thio-, 1-[5-(methylsulfinyl)-N-(sulfooxy)pentanimidate], Glucopyranose, 1-thio-, 1-[5-(methylsulfinyl)valerohydroximate] NO-(hydrogen sulfate), ß-D- (8CI), 4-Methylsulfinylbutyl glucosinolate, Glucorafanin, Sulforaphane glucosinolate, 1-S-[(1E)-5-(methylsulfinyl)-N-(sulfonatooxy)pentanimidoyl]-1-thio-beta-D-glucopyranose, Ccris 9055, Glucopyranose, 1-thio-, 1-[5-(methylsulfinyl)valerohydroximate] NO-(hydrogen sulfate), β-<span class="text-smallcaps">D</span>-, beta-D-Glucopyranose, 1-thio-, 1-(5-(methylsulfinyl)-N-(sulfooxy)pentanimidate), β-<span class="text-smallcaps">D</span>-Glucopyranose, 1-thio-, 1-[5-(methylsulfinyl)-N-(sulfooxy)pentanimidate]
• CAS: 21414-41-5

Description

Applications Glucoraphanin is a natural glycoinsolate found in cruciferous vegetables. Glucophanin (Sulforaphane), is a bioactive component in brocolli and is digested by gut bacteria to produce chemopreventive agents.
References Luang-In, V. et al.: Mol. Nutr. Food. Res., 58, 875 (2014); Blazevic, I. et al.: Nat. Prod. Comm., 8, 1463 (2013);

• Brand: TRC

Chemical properties

• Molecular weight: 437.51
• Formula: C₁₂H₂₃NO₁₀S₃
• Color/Form: Off-White
• InChI: InChI=1S/C12H23NO10S3/c1-25(18)5-3-2-4-8(13-23-26(19,20)21)24-12-11(17)10(16)9(15)7(6-14)22-12/h7,9-12,14-17H,2-6H2,1H3,(H,19,20,21)/t7-,9-,10+,11-,12+,25?/m1/s1
• InChI key: InChIKey=GMMLNKINDDUDCF-BYNGITTOSA-N
• SMILES: CS(=O)CCCC/C(=N/OS(=O)(=O)O)S[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O