Chem
J-GLOBAL ID:200907016700923812   Nikkaji number:J862.416J

2-[(4-Cyanobenzoyl)oxy]-3-(heptadecanoyloxy)butanedioic acid

2-(4-シアノベンゾイルオキシ)-3-(ヘプタデカノイルオキシ)ブタン二酸
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: C29H41NO8
Molecular formula furigana: C29-H41-N-O8
Molecular weight: 531.646
InChI: InChI=1S/C29H41NO8/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-24(31)37-25(27(32)33)26(28(34)35)38-29(36)23-19-17-22(21-30)18-20-23/h17-20,25-26H,2-16H2,1H3,(H,32,33)(H,34,35)
InChI key: COJMVBOIPRASGV-UHFFFAOYSA-N
SMILES: CCCCCCCCCCCCCCCCC(=O)OC(C(OC(=O)c1ccc(cc1)C#N)C(=O)O)C(=O)O
Systematic name  (3):
  • 2-[(4-シアノベンゾイル)オキシ]-3-(ヘプタデカノイルオキシ)ブタン二酸
  • 2-(4-シアノベンゾイルオキシ)-3-(ヘプタデカノイルオキシ)ブタン二酸
  • 2-(4-cyanobenzoyloxy)-3-(heptadecanoyloxy)butanedioic acid
Other name (1):
  • 2-[(4-Cyanobenzoyl)oxy]-3-(heptadecanoyloxy)butanedioic acid
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