(Q63412492)

English

1-(11Z,14Z-eicosadienoyl)-2-(8Z,11Z,14Z-eicosatrienoyl)-glycero-3-phospho-(1'-myo-inositol)

chemical compound

PI(20:2(11Z,14Z)/20:3(8Z,11Z,14Z))

In more languages

Statements

group of stereoisomers

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diacylglycerophosphoinositols

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912.57277941 dalton

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based on heuristic

inferred from isomeric SMILES

chemical formula

C₄₉H₈₅O₁₃P

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canonical SMILES

CCCCCC=CCC=CCC=CCCCCCCC(=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(CCCCCC/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/C49H85O13P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-42(50)59-39-41(40-60-63(57,58)62-49-47(55)45(53)44(52)46(54)48(49)56)61-43(51)38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h11-14,17-20,24,26,41,44-49,52-56H,3-10,15-16,21-23,25,27-40H2,1-2H3,(H,57,58)/b13-11-,14-12-,19-17-,20-18-,26-24-/t41-,44?,45-,46?,47?,48?,49-/m1/s1

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XIPIGWOPGNVNAS-DEFBQSRRSA-N

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