Chem
J-GLOBAL ID：200907075257995399   Nikkaji number：J797.487F

1-O,3-O-Dipalmitoyl-2-O-[(4E,7E,10E,13E,16E,19E)-1-oxo-4,7,10,13,16,19-docosahexen-1-yl]glycerol

1,3-ビス(ヘキサデカノイルオキシ)プロパン-2-イル (4E,7E,10E,13E,16E,19E)-ドコサ-4,7,10,13,16,19-ヘキサエノアート
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： C57H98O6
Molecular formula furigana： C57-H98-O6
Molecular weight： 879.405
InChI： InChI=1S/C57H98O6/c1-4-7-10-13-16-19-22-25-26-27-28-29-30-33-36-39-42-45-48-51-57(60)63-54(52-61-55(58)49-46-43-40-37-34-31-23-20-17-14-11-8-5-2)53-62-56(59)50-47-44-41-38-35-32-24-21-18-15-12-9-6-3/h7,10,16,19,25-26,28-29,33,36,42,45,54H,4-6,8-9,11-15,17-18,20-24,27,30-32,34-35,37-41,43-44,46-53H2,1-3H3/b10-7+,19-16+,26-25+,29-28+,36-33+,45-42+
InChI key： FBUBTADVAQJSNW-NVRQFXDCSA-N
SMILES： CCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCC)OC(=O)CC/C=C/C/C=C/C/C=C/C/C=C/C/C=C/C/C=C/CC
Systematic name  (3)：
  • 1-O,3-O-ジパルミトイル-2-O-[(4E,7E,10E,13E,16E,19E)-1-オキソ-4,7,10,13,16,19-ドコサヘキサエン-1-イル]グリセロール
  • 1,3-ビス(ヘキサデカノイルオキシ)プロパン-2-イル (4E,7E,10E,13E,16E,19E)-ドコサ-4,7,10,13,16,19-ヘキサエノアート
  • 1,3-bis(hexadecanoyloxy)propan-2-yl (4E,7E,10E,13E,16E,19E)-docosa-4,7,10,13,16,19-hexaenoate
Other name (1)：
  • 1-O,3-O-Dipalmitoyl-2-O-[(4E,7E,10E,13E,16E,19E)-1-oxo-4,7,10,13,16,19-docosahexen-1-yl]glycerol
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