Chem
J-GLOBAL ID：200907041039306903   Nikkaji number：J2.737.604E

N-[2-[[2-O-[(4Z,7Z,10Z,13Z,16Z,19Z)-1-Oxo-4,7,10,13,16,19-docosahexaenyl]-1-O-stearoyl-L-glycero-3-phospho]oxy]ethyl]glycine

N-[2-[[2-O-[(4Z,7Z,10Z,13Z,16Z,19Z)-1-オキソ-4,7,10,13,16,19-ドコサヘキサエニル]-1-O-ステアロイル-L-グリセロ-3-ホスホ]オキシ]エチル]グリシン
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： C47H80NO10P
Molecular formula furigana： C47-H80-N-O10-P
Molecular weight： 850.128
InChI： InChI=1S/C47H80NO10P/c1-3-5-7-9-11-13-15-17-19-20-21-22-24-26-28-30-32-34-36-38-47(52)58-44(43-57-59(53,54)56-40-39-48-41-45(49)50)42-55-46(51)37-35-33-31-29-27-25-23-18-16-14-12-10-8-6-4-2/h5,7,11,13,17,19,21-22,26,28,32,34,44,48H,3-4,6,8-10,12,14-16,18,20,23-25,27,29-31,33,35-43H2,1-2H3,(H,49,50)(H,53,54)/b7-5-,13-11-,19-17-,22-21-,28-26-,34-32-/t44-/m1/s1
InChI key： LWLUCGPFGBFSRB-KEBMQMEXSA-N
SMILES： CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)(O)OCCNCC(=O)O)OC(=O)CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC
Systematic name  (3)：
  • N-[2-[[2-O-[(4Z,7Z,10Z,13Z,16Z,19Z)-1-オキソ-4,7,10,13,16,19-ドコサヘキサエニル]-1-O-ステアロイル-L-グリセロ-3-ホスホ]オキシ]エチル]グリシン
  • 2-{[2-({[(2R)-2-[(4Z,7Z,10Z,13Z,16Z,19Z)-ドコサ-4,7,10,13,16,19-ヘキサエノイルオキシ]-3-(オクタデカノイルオキシ)プロポキシ](ヒドロキシ)ホスホリル}オキシ)エチル]アミノ}酢酸
  • 2-{[2-({[(2R)-2-[(4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoyloxy]-3-(octadecanoyloxy)propoxy](hydroxy)phosphoryl}oxy)ethyl]amino}acetic acid
Other name (1)：
  • N-[2-[[2-O-[(4Z,7Z,10Z,13Z,16Z,19Z)-1-Oxo-4,7,10,13,16,19-docosahexaenyl]-1-O-stearoyl-L-glycero-3-phospho]oxy]ethyl]glycine
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