Chem
J-GLOBAL ID:200907051331153552   Nikkaji number:J2.299.823D

N-(Dioctadecylcarbamoylmethoxyacetyl)-Gly-Gly-Gly-Pro-3-(benzyloxycarbonylmethyl)-Ala-Ala-Gly-OHheptyl

N-(ジオクタデシルカルバモイルメトキシアセチル)-Gly-Gly-Gly-Pro-3-(ベンジルオキシカルボニルメチル)-Ala-Ala-Gly-OH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: C75H130N8O13
Molecular formula furigana: C75-H130-N8-O13
Molecular weight: 1351.908
InChI: InChI=1S/C75H130N8O13/c1-5-8-11-14-16-18-20-22-24-26-28-30-32-34-36-42-51-82(52-43-37-35-33-31-29-27-25-23-21-19-17-15-12-9-6-2)70(88)61-94-60-68(86)77-56-66(84)76-55-67(85)78-57-69(87)83-53-45-48-65(83)75(93)81-64(49-50-71(89)96-59-63-46-40-39-41-47-63)74(92)80-62(4)73(91)79-58-72(90)95-54-44-38-13-10-7-3/h39-41,46-47,62,64-65H,5-38,42-45,48-61H2,1-4H3,(H,76,84)(H,77,86)(H,78,85)(H,79,91)(H,80,92)(H,81,93)/t62-,64-,65-/m0/s1
InChI key: GOSWUNIDDAYYFH-WLTVXCEKSA-N
SMILES: CCCCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCCCC)C(=O)COCC(=O)NCC(=O)NCC(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)OCc1ccccc1)C(=O)N[C@@H](C)C(=O)NCC(=O)OCCCCCCC
Systematic name  (3):
  • N-(ジオクタデシルカルバモイルメトキシアセチル)-Gly-Gly-Gly-Pro-3-(ベンジルオキシカルボニルメチル)-Ala-Ala-Gly-OHヘプチル
  • ベンジル (4S)-4-{[(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}-4-{[(1S)-1-{[2-(ヘプチルオキシ)-2-オキソエチル]カルバモイル}エチル]カルバモイル}ブタノアート
  • benzyl (4S)-4-{[(2S)-1-{2-[2-(2-{2-[(dioctadecylcarbamoyl)methoxy]acetamido}acetamido)acetamido]acetyl}pyrrolidin-2-yl]formamido}-4-{[(1S)-1-{[2-(heptyloxy)-2-oxoethyl]carbamoyl}ethyl]carbamoyl}butanoate
Other name (1):
  • N-(Dioctadecylcarbamoylmethoxyacetyl)-Gly-Gly-Gly-Pro-3-(benzyloxycarbonylmethyl)-Ala-Ala-Gly-OHheptyl
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