Chem
J-GLOBAL ID:200907093284591524   Nikkaji number:J1.568.256F

(2S,3R,4R)-2-(Methylamino)-3-(tosylamino)-4-methyl-6-octenoic acid methyl ester

(2S,3R,4R)-2-(メチルアミノ)-3-(トシルアミノ)-4-メチル-6-オクテン酸メチル
Substance type:
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula: C18H28N2O4S
Molecular formula furigana: C18-H28-N2-O4-S
Molecular weight: 368.490
InChI: InChI=1S/C18H28N2O4S/c1-6-7-8-14(3)16(17(19-4)18(21)24-5)20-25(22,23)15-11-9-13(2)10-12-15/h6-7,9-12,14,16-17,19-20H,8H2,1-5H3/t14-,16-,17+/m1/s1
InChI key: BKDHKYPQJOHOHV-OIISXLGYSA-N
SMILES: CN[C@@H]([C@H](NS(=O)(=O)c1ccc(C)cc1)[C@H](C)CC=CC)C(=O)OC
Systematic name  (3):
  • (2S,3R,4R)-2-(メチルアミノ)-3-(トシルアミノ)-4-メチル-6-オクテン酸メチル
  • メチル (2S,3R,4R)-4-メチル-2-(メチルアミノ)-3-(4-メチルベンゼンスルホンアミド)オクタ-6-エノアート
  • methyl (2S,3R,4R)-4-methyl-2-(methylamino)-3-(4-methylbenzenesulfonamido)oct-6-enoate
Other name (1):
  • (2S,3R,4R)-2-(Methylamino)-3-(tosylamino)-4-methyl-6-octenoic acid methyl ester
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