Chem
J-GLOBAL ID:200907027172336820   Nikkaji number:J1.177.304D

N-(3,5-Dinitrobenzoyl)-O-(3-amino-2-butenoyl)-D-threonine methyl ester

N-(3,5-ジニトロベンゾイル)-O-(3-アミノ-2-ブテノイル)-D-トレオニンメチル
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: C16H18N2[N+]2O7[O-]2
Molecular formula furigana: C16-H18-N4-O9
Molecular weight: 410.339
InChI: InChI=1S/C16H18N4O9/c1-8(17)4-13(21)29-9(2)14(16(23)28-3)18-15(22)10-5-11(19(24)25)7-12(6-10)20(26)27/h4-7,9,14H,17H2,1-3H3,(H,18,22)/t9-,14+/m0/s1
InChI key: CQHFUHFYOGVAEE-LKFCYVNXSA-N
SMILES: COC(=O)[C@H](NC(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-])[C@H](C)OC(=O)C=C(C)N
Systematic name  (3):
  • N-(3,5-ジニトロベンゾイル)-O-(3-アミノ-2-ブテノイル)-D-トレオニンメチル
  • (2S,3R)-3-[(3,5-ジニトロフェニル)ホルムアミド]-4-メトキシ-4-オキソブタン-2-イル 3-アミノブタ-2-エノアート
  • (2S,3R)-3-[(3,5-dinitrophenyl)formamido]-4-methoxy-4-oxobutan-2-yl 3-aminobut-2-enoate
Other name (1):
  • N-(3,5-Dinitrobenzoyl)-O-(3-amino-2-butenoyl)-D-threonine methyl ester
Thsaurus map:

Return to Previous Page