Chem
J-GLOBAL ID:200907005351133505   Nikkaji number:J1.293.401G

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

D-myo-イノシトール1-O-りん酸2,3-ビス(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: C45H87O13P
Molecular formula furigana: C45-H87-O13-P
Molecular weight: 867.152
InChI: InChI=1S/C45H87O13P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-38(46)55-35-37(36-56-59(53,54)58-45-43(51)41(49)40(48)42(50)44(45)52)57-39(47)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h37,40-45,48-52H,3-36H2,1-2H3,(H,53,54)/t37?,40-,41-,42+,43-,44-,45?/m1/s1
InChI key: FQZQXPXKJFOAGE-FGHBCMGFSA-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)CCCCCCCCCCCCCCCCC
Systematic name  (3):
  • D-myo-イノシトール1-O-りん酸2,3-ビス(ステアロイルオキシ)プロピル
  • [2,3-ビス(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
  • [2,3-bis(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 2,3-bis(stearoyloxy)propyl ester
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