Chem
J-GLOBAL ID：200907082164932695   Nikkaji number：J2.171.290F

Dotriacontanedioic acid 1-[(R)-1-[oxylato[2-(trimethylaminio)ethoxy]phosphinyloxymethyl]-2-(1-oxohexadecyloxy)ethyl]-32-[(S)-1-(aminomethyl)-2-(1-oxohexadecyloxy)ethyl] ester

ドトリアコンタン二酸1-[(R)-1-[オキシラト[2-(トリメチルアミニオ)エトキシ]ホスフィニルオキシメチル]-2-(1-オキソヘキサデシルオキシ)エチル]-32-[(S)-1-(アミノメチル)-2-(1-オキソヘキサデシルオキシ)エチル]
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： C75H147N[N+]O11[O-]P
Molecular formula furigana： C75-H147-N2-O12-P
Molecular weight： 1299.977
InChI： InChI=1S/C75H147N2O12P/c1-6-8-10-12-14-16-18-36-40-44-48-52-56-60-72(78)84-67-70(66-76)88-74(80)62-58-54-50-46-42-38-34-32-30-28-26-24-22-20-21-23-25-27-29-31-33-35-39-43-47-51-55-59-63-75(81)89-71(69-87-90(82,83)86-65-64-77(3,4)5)68-85-73(79)61-57-53-49-45-41-37-19-17-15-13-11-9-7-2/h70-71H,6-69,76H2,1-5H3/t70-,71+/m0/s1
InChI key： VQARXFQMLPLTMD-CLLAMJHGSA-N
SMILES： CCCCCCCCCCCCCCCC(=O)OC[C@H](CN)OC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C
Systematic name  (3)：
  • ドトリアコンタン二酸1-[(R)-1-[オキシラト[2-(トリメチルアミニオ)エトキシ]ホスフィニルオキシメチル]-2-(1-オキソヘキサデシルオキシ)エチル]-32-[(S)-1-(アミノメチル)-2-(1-オキソヘキサデシルオキシ)エチル]
  • (2-{[(2R)-2-[(32-{[(2S)-1-アミノ-3-(ヘキサデカノイルオキシ)プロパン-2-イル]オキシ}-32-オキソドトリアコンタノイル)オキシ]-3-(ヘキサデカノイルオキシ)プロピル ホスホナト]オキシ}エチル)トリメチルアザニウム
  • (2-{[(2R)-2-[(32-{[(2S)-1-amino-3-(hexadecanoyloxy)propan-2-yl]oxy}-32-oxodotriacontanoyl)oxy]-3-(hexadecanoyloxy)propyl phosphonato]oxy}ethyl)trimethylazanium
Other name (1)：
  • Dotriacontanedioic acid 1-[(R)-1-[oxylato[2-(trimethylaminio)ethoxy]phosphinyloxymethyl]-2-(1-oxohexadecyloxy)ethyl]-32-[(S)-1-(aminomethyl)-2-(1-oxohexadecyloxy)ethyl] ester
Thsaurus map：
Thesaurus Map

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