(Q63410437)

English

1-(9Z-pentadecenoyl)-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-glycero-3-phospho-(1'-myo-inositol)

chemical compound

PI(15:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))

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Statements

group of stereoisomers

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diacylglycerophosphoinositols

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866.49452909 dalton

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based on heuristic

inferred from isomeric SMILES

chemical formula

C₄₆H₇₅O₁₃P

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canonical SMILES

CCC=CCC=CCC=CCC=CCC=CCC=CCCC(=O)OC(COC(=O)CCCCCCCC=CCCCCC)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O

1 reference

based on heuristic

inferred from isomeric SMILES

isomeric SMILES

[C@]([H])(OC(CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC)=O)(COP(=O)(O)O[C@@H]1C(O)[C@H](O)C(O)C(O)C1O)COC(CCCCCCC/C=C\CCCCC)=O

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Identifiers

InChI=1S/C46H75O13P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-25-27-29-31-33-35-40(48)58-38(36-56-39(47)34-32-30-28-26-24-16-14-12-10-8-6-4-2)37-57-60(54,55)59-46-44(52)42(50)41(49)43(51)45(46)53/h5,7,11-14,17-18,20-21,23,25,29,31,38,41-46,49-53H,3-4,6,8-10,15-16,19,22,24,26-28,30,32-37H2,1-2H3,(H,54,55)/b7-5-,13-11-,14-12-,18-17-,21-20-,25-23-,31-29-/t38-,41?,42-,43?,44?,45?,46-/m1/s1

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WMYDIWPMLIKXTB-VIYWIKOYSA-N

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