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芝麻菜苷
Glucoerucin
Hexopyranose, 1-S-[[5-(methylthio)-1-oxopentyl](sulfooxy)amino]-1-thio-, Glucoerucin, EINECS 244-689-8, [(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 5-methylsulfanyl-N-sulfooxypentanimidothioate, 4-methylthiobutyl glucosinolate, 1-S-{[5-(Methylsulfanyl)pentanoyl](sulfooxy)amino}-1-thiohexopyranose
CAS号: 21973-56-8
IUPAC名称: [(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 5-methylsulfanyl-N-sulfooxypentanimidothioate
分子式: C12H23NO10S3
分子量: 437.507
InChI: InChI=1S/C12H23NO9S3/c1-23-5-3-2-4-8(13-22-25(18,19)20)24-12-11(17)10(16)9(15)7(6-14)21-12/h7,9-12,14-17H,2-6H2,1H3,(H,18,19,20)/t7-,9-,10+,11-,12+/m1/s1
InChIKey: GKUMMDFLKGFCKH-URYVQPGZSA-N
SMILES: CSCCCCC(=NOS(=O)(=O)O)S[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O
EINECS: -
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