$85.00 – $450.00
| CAS No.: | 28463-24-3 |
| Molecular Formula | C₁₂H₂₁NO₁₀S₃ |
| Molecular Weight | 435.5g/mol |
| Purity | HPLC>98% |
| Chemical Family | Aliphatics |
IUPAC Name: [(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (E,1E)-5-methylsulfinyl-N-sulfooxypent-4-enimidothioate
InChI: InChI=1S/C12H21NO10S3/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/h3,5,7,9-12,14-17H,2,4,6H2,1H3,(H,19,20,21)/b5-3+,13-8+/t7-,9-,10+,11-,12+,25?/m1/s1
InChIKey: ZFLXCZJBYSPSKU-CRHREIPCSA-N
Canonical SMILES: CS(=O)C=CCCC(=NOS(=O)(=O)O)SC1C(C(C(C(O1)CO)O)O)O
Isomeric SMILES: CS(=O)/C=C/CC/C(=NOS(=O)(=O)O)/S[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O
Synonyms: Glucoraphenin; 28463-24-3; 4-Methylsulfinyl-3-butenyl glucosinolate; [(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (E,1E)-5-methylsulfinyl-N-sulfooxypent-4-enimidothioate; Glucoraphasatin sulfoxide; 4-methylsulfinyl-3-butenyl GL; beta-D-Glucopyranose, 1-thio-, 1-(5-(methylsulfinyl)-N-(sulfooxy)-4- pentenimidate); (((5-(Methylsulfinyl)-1-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)thio)pent-4-en-1-ylidene)amino)oxy)sulfonic acid
Botanical Source: Raphanus sativus L.
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