Chem
J-GLOBAL ID：200907020120941144   Nikkaji number：J2.171.288D

Docosanedioic acid 1-[(R)-1-[oxylato[2-(trimethylaminio)ethoxy]phosphinyloxymethyl]-2-(1-oxoundecyloxy)ethyl]-22-[(S)-1-(aminomethyl)-2-(1-oxoundecyloxy)ethyl] ester

ドコサン二酸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-オキソウンデシルオキシ)エチル]-22-[(S)-1-(アミノメチル)-2-(1-オキソウンデシルオキシ)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： C55H107N[N+]O11[O-]P
Molecular formula furigana： C55-H107-N2-O12-P
Molecular weight： 1019.437
InChI： InChI=1S/C55H107N2O12P/c1-6-8-10-12-14-28-32-36-40-52(58)64-47-50(46-56)68-54(60)42-38-34-30-26-24-22-20-18-16-17-19-21-23-25-27-31-35-39-43-55(61)69-51(49-67-70(62,63)66-45-44-57(3,4)5)48-65-53(59)41-37-33-29-15-13-11-9-7-2/h50-51H,6-49,56H2,1-5H3/t50-,51+/m0/s1
InChI key： VQGFPLJBXMHXQD-OKPYTHRESA-N
SMILES： CCCCCCCCCCC(=O)OC[C@H](CN)OC(=O)CCCCCCCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C
Systematic name  (3)：
  • ドコサン二酸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-オキソウンデシルオキシ)エチル]-22-[(S)-1-(アミノメチル)-2-(1-オキソウンデシルオキシ)エチル]
  • (2-{[(2R)-2-[(22-{[(2S)-1-アミノ-3-(ウンデカノイルオキシ)プロパン-2-イル]オキシ}-22-オキソドコサノイル)オキシ]-3-(ウンデカノイルオキシ)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-[(22-{[(2S)-1-amino-3-(undecanoyloxy)propan-2-yl]oxy}-22-oxodocosanoyl)oxy]-3-(undecanoyloxy)propyl phosphonato]oxy}ethyl)trimethylazanium
Other name (1)：
  • Docosanedioic acid 1-[(R)-1-[oxylato[2-(trimethylaminio)ethoxy]phosphinyloxymethyl]-2-(1-oxoundecyloxy)ethyl]-22-[(S)-1-(aminomethyl)-2-(1-oxoundecyloxy)ethyl] ester
Thsaurus map：
Thesaurus Map

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