Chem
J-GLOBAL ID：201807011288523225   Nikkaji number：J3.727.879C

(2S,3E,5R)-2-Methyl-2-[(trichloroacetyl)amino]-5-hydroxy-6-[(benzyloxy)methoxy]-3-hexenoic acid methyl ester

(2S,3E,5R)-2-メチル-2-[(トリクロロアセチル)アミノ]-5-ヒドロキシ-6-[(ベンジルオキシ)メトキシ]-3-ヘキセン酸メチル
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： C18H22Cl3NO6
Molecular formula furigana： C18-H22-CL3-N-O6
Molecular weight： 454.730
InChI： InChI=1S/C18H22Cl3NO6/c1-17(16(25)26-2,22-15(24)18(19,20)21)9-8-14(23)11-28-12-27-10-13-6-4-3-5-7-13/h3-9,14,23H,10-12H2,1-2H3,(H,22,24)/b9-8+/t14-,17+/m1/s1
InChI key： ZQLDJARYLRTIBU-KPBXEYHCSA-N
SMILES： COC(=O)[C@@](C)(NC(=O)C(Cl)(Cl)Cl)/C=C/[C@@H](O)COCOCc1ccccc1
Systematic name  (3)：
  • (2S,3E,5R)-2-メチル-2-[(トリクロロアセチル)アミノ]-5-ヒドロキシ-6-[(ベンジルオキシ)メトキシ]-3-ヘキセン酸メチル
  • メチル (2S,3E,5R)-6-[(ベンジルオキシ)メトキシ]-5-ヒドロキシ-2-メチル-2-(2,2,2-トリクロロアセトアミド)ヘキサ-3-エノアート
  • methyl (2S,3E,5R)-6-[(benzyloxy)methoxy]-5-hydroxy-2-methyl-2-(2,2,2-trichloroacetamido)hex-3-enoate
Other name (1)：
  • (2S,3E,5R)-2-Methyl-2-[(trichloroacetyl)amino]-5-hydroxy-6-[(benzyloxy)methoxy]-3-hexenoic acid methyl ester
Thsaurus map：
Thesaurus Map

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