(Q63332405)

English

PI(17:0/20:4(5Z,8Z,11Z,14Z))

group of stereoisomers with the chemical formula C₄₆H₈₁O₁₃P

1-heptadecanoyl-2-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-sn-glycero-3-phospho-(1'- myo-inositol)

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instance of

group of stereoisomers

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subclass of

diacylglycerophosphoinositols

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lipid

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mass

872.541479282 dalton

1 reference

based on heuristic

inferred from isomeric SMILES

chemical formula

C₄₆H₈₁O₁₃P

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canonical SMILES

CCCCCC=CCC=CCC=CCC=CCCCC(=O)OC(COC(=O)CCCCCCCCCCCCCCCC)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(CCC/C=C\C/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(CCCCCCCCCCCCCCCC)=O

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Identifiers

InChI

InChI=1S/C46H81O13P/c1-3-5-7-9-11-13-15-17-19-20-21-23-25-27-29-31-33-35-40(48)58-38(37-57-60(54,55)59-46-44(52)42(50)41(49)43(51)45(46)53)36-56-39(47)34-32-30-28-26-24-22-18-16-14-12-10-8-6-4-2/h11,13,17,19,21,23,27,29,38,41-46,49-53H,3-10,12,14-16,18,20,22,24-26,28,30-37H2,1-2H3,(H,54,55)/b13-11-,19-17-,23-21-,29-27-/t38-,41?,42-,43?,44?,45?,46-/m1/s1

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InChIKey

IVKFRZJXXGDYJH-CKRYNKIBSA-N

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LIPID MAPS ID

LMGP06010004

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(Q63332405)

PI(17:0/20:4(5Z,8Z,11Z,14Z))

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