Chem
J-GLOBAL ID：200907093255644520   Nikkaji number：J634.626J

1-O-(1-O,2-O-Dioctanoyl-L-glycero-3-phospho)-D-myo-inositol 3,4,5-trisphosphoric acid

1-O-(1-O,2-O-ジオクタノイル-L-グリセロ-3-ホスホ)-D-myo-イノシトール3,4,5-トリスりん酸
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： C25H50O22P4
Molecular formula furigana： C25-H50-O22-P4
Molecular weight： 826.548
InChI： InChI=1S/C25H50O22P4/c1-3-5-7-9-11-13-18(26)41-15-17(43-19(27)14-12-10-8-6-4-2)16-42-51(39,40)47-22-20(28)23(44-48(30,31)32)25(46-50(36,37)38)24(21(22)29)45-49(33,34)35/h17,20-25,28-29H,3-16H2,1-2H3,(H,39,40)(H2,30,31,32)(H2,33,34,35)(H2,36,37,38)/t17-,20+,21+,22-,23+,24-,25?/m1/s1
InChI key： ANFYVAHJWGJYAT-IUCJVUNFSA-N
SMILES： CCCCCCCC(=O)OC[C@H](COP(=O)(O)O[C@@H]1[C@H](O)[C@H](OP(=O)(O)O)C(OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H]1O)OC(=O)CCCCCCC
Systematic name  (4)：
  • 1-O-[[(R)-2,3-ビス(オクタノイルオキシ)プロポキシ]ホスホニル]-D-myo-イノシトール3,4,5-トリスりん酸
  • 1-O-(1-O,2-O-ジオクタノイル-L-グリセロ-3-ホスホ)-D-myo-イノシトール3,4,5-トリスりん酸
  • {[(1S,2S,3S,4S,5R)-3-({[(2R)-2,3-ビス(オクタノイルオキシ)プロポキシ](ヒドロキシ)ホスホリル}オキシ)-2,4-ジヒドロキシ-5,6-ビス(ホスホノオキシ)シクロヘキシル]オキシ}ホスホン酸
  • {[(1S,2S,3S,4S,5R)-3-({[(2R)-2,3-bis(octanoyloxy)propoxy](hydroxy)phosphoryl}oxy)-2,4-dihydroxy-5,6-bis(phosphonooxy)cyclohexyl]oxy}phosphonic acid
Other name (2)：
  • 1-O-[[(R)-2,3-Bis(octanoyloxy)propoxy]phosphonyl]-D-myo-inositol 3,4,5-trisphosphoric acid
  • 1-O-(1-O,2-O-Dioctanoyl-L-glycero-3-phospho)-D-myo-inositol 3,4,5-trisphosphoric acid
Thsaurus map：
Thesaurus Map

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