(Q82695313)

English

(2R)-3-{[(2,3-Dihydroxypropoxy)(hydroxy)phosphoryl]oxy}-2-(octadecanoyloxy)propyl octadecanoate--ammonia (1/1)

group of stereoisomers with the chemical formula C₄₂H₈₆NO₁₀P

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Statements

group of stereoisomers

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chemical compound

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795.5989345819997 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₄₂H₈₆NO₁₀P

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based on heuristic

inferred from SMILES

canonical SMILES

CCCCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCC(O)CO)OC(=O)CCCCCCCCCCCCCCCCC.N

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based on heuristic

inferred from isomeric SMILES

isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)(O)OCC(O)CO)OC(=O)CCCCCCCCCCCCCCCCC.N

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based on heuristic

inferred from InChI

Identifiers

InChI=1S/C42H83O10P.H3N/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-41(45)49-37-40(38-51-53(47,48)50-36-39(44)35-43)52-42(46)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;/h39-40,43-44H,3-38H2,1-2H3,(H,47,48);1H3/t39?,40-;/m1./s1

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PJOUKPGQSVEHLZ-QTOMIGAPSA-N

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CAS Registry Number

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DSSTox substance ID

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DSSTOX compound identifier

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