Chem
J-GLOBAL ID：200907081251160104   Nikkaji number：J1.293.397E

D-myo-Inositol 1-O-phosphoric acid 2-acetoxy-3-(stearoyloxy)propyl ester

D-myo-イノシトール1-O-りん酸2-アセトキシ-3-(ステアロイルオキシ)プロピル
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： C29H55O13P
Molecular formula furigana： C29-H55-O13-P
Molecular weight： 642.720
InChI： InChI=1S/C29H55O13P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23(31)39-19-22(41-21(2)30)20-40-43(37,38)42-29-27(35)25(33)24(32)26(34)28(29)36/h22,24-29,32-36H,3-20H2,1-2H3,(H,37,38)/t22?,24-,25-,26+,27-,28-,29?/m1/s1
InChI key： GPNGXRCNUOYDCE-XACNDEDESA-N
SMILES： CCCCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OC1[C@H](O)[C@@H](O)[C@H](O)[C@@H](O)[C@H]1O)OC(=O)C
Systematic name  (3)：
  • D-myo-イノシトール1-O-りん酸2-アセトキシ-3-(ステアロイルオキシ)プロピル
  • [2-(アセチルオキシ)-3-(オクタデカノイルオキシ)プロポキシ]({[(2R,3R,4S,5S,6R)-2,3,4,5,6-ペンタヒドロキシシクロヘキシル]オキシ})ホスフィン酸
  • [2-(acetyloxy)-3-(octadecanoyloxy)propoxy]({[(2R,3R,4S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyl]oxy})phosphinic acid
Other name (1)：
  • D-myo-Inositol 1-O-phosphoric acid 2-acetoxy-3-(stearoyloxy)propyl ester
Thsaurus map：
Thesaurus Map

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