Chem
J-GLOBAL ID:200907009394241498   Nikkaji number:J2.564.941I

N-[N-[2-[(Dioctadecylcarbamoyl)methoxy]acetyl]-Gly-Gly-Gly-L-Pro-Gly-5-oxo-5-(benzyloxy)-L-Nva-]glycine heptyl ester

N-[N-[2-[(ジオクタデシルカルバモイル)メトキシ]アセチル]-Gly-Gly-Gly-L-Pro-Gly-5-オキソ-5-(ベンジルオキシ)-L-Nva-]グリシンヘプチル
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: C74H128N8O13
Molecular formula furigana: C74-H128-N8-O13
Molecular weight: 1337.881
InChI: InChI=1S/C74H128N8O13/c1-4-7-10-13-15-17-19-21-23-25-27-29-31-33-35-41-50-81(51-42-36-34-32-30-28-26-24-22-20-18-16-14-11-8-5-2)70(88)61-93-60-68(86)76-55-65(83)75-54-66(84)77-57-69(87)82-52-44-47-64(82)74(92)78-56-67(85)80-63(48-49-71(89)95-59-62-45-39-38-40-46-62)73(91)79-58-72(90)94-53-43-37-12-9-6-3/h38-40,45-46,63-64H,4-37,41-44,47-61H2,1-3H3,(H,75,83)(H,76,86)(H,77,84)(H,78,92)(H,79,91)(H,80,85)/t63-,64-/m0/s1
InChI key: JQPBYNUGKXAFLE-VKOZLBNWSA-N
SMILES: CCCCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCCCC)C(=O)COCC(=O)NCC(=O)NCC(=O)NCC(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CCC(=O)OCc1ccccc1)C(=O)NCC(=O)OCCCCCCC
Systematic name  (3):
  • N-[N-[2-[(ジオクタデシルカルバモイル)メトキシ]アセチル]-Gly-Gly-Gly-L-Pro-Gly-5-オキソ-5-(ベンジルオキシ)-L-Nva-]グリシンヘプチル
  • ベンジル (4S)-4-(2-{[(2S)-1-{2-[2-(2-{2-[(ジオクタデシルカルバモイル)メトキシ]アセトアミド}アセトアミド)アセトアミド]アセチル}ピロリジン-2-イル]ホルムアミド}アセトアミド)-4-{[2-(ヘプチルオキシ)-2-オキソエチル]カルバモイル}ブタノアート
  • benzyl (4S)-4-(2-{[(2S)-1-{2-[2-(2-{2-[(dioctadecylcarbamoyl)methoxy]acetamido}acetamido)acetamido]acetyl}pyrrolidin-2-yl]formamido}acetamido)-4-{[2-(heptyloxy)-2-oxoethyl]carbamoyl}butanoate
Other name (1):
  • N-[N-[2-[(Dioctadecylcarbamoyl)methoxy]acetyl]-Gly-Gly-Gly-L-Pro-Gly-5-oxo-5-(benzyloxy)-L-Nva-]glycine heptyl ester
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