(Q63410068)

English

1-(11Z,14Z-eicosadienoyl)-2-(6Z,9Z,12Z-octadecatrienoyl)-glycero-3-phospho-(1'-myo-inositol)

chemical compound

PI(20:2(11Z,14Z)/18:3(6Z,9Z,12Z))

In more languages

Statements

group of stereoisomers

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diacylglycerophosphoinositols

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884.5414792819998 dalton

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based on heuristic

inferred from isomeric SMILES

chemical formula

C₄₇H₈₁O₁₃P

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canonical SMILES

CCCCCC=CCC=CCC=CCCCCC(=O)OC(COC(=O)CCCCCCCCCC=CCC=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(CCCC/C=C\C/C=C\C/C=C\CCCCC)=O)(COP(=O)(O)O[C@@H]1C(O)[C@H](O)C(O)C(O)C1O)COC(CCCCCCCCC/C=C\C/C=C\CCCCC)=O

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Identifiers

InChI=1S/C47H81O13P/c1-3-5-7-9-11-13-15-17-19-20-22-23-25-27-29-31-33-35-40(48)57-37-39(38-58-61(55,56)60-47-45(53)43(51)42(50)44(52)46(47)54)59-41(49)36-34-32-30-28-26-24-21-18-16-14-12-10-8-6-4-2/h11-14,17-19,21,26,28,39,42-47,50-54H,3-10,15-16,20,22-25,27,29-38H2,1-2H3,(H,55,56)/b13-11-,14-12-,19-17-,21-18-,28-26-/t39-,42?,43-,44?,45?,46?,47-/m1/s1

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PSPQZPIQLHRXPT-WKMGZWHYSA-N

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