(Q120301282)

English

1-hexadecanoyl-2-(9E,12E-octadecadienoyl)-sn-glycero-3-phosphocholine

chemical compound

In more languages

Statements

type of chemical entity

0 references

phosphatidylcholine

1 reference

based on heuristic

inferred from SMILES

757.56215515 dalton

1 reference

based on heuristic

inferred from isomeric SMILES

stereoisomer of

1-hexadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphocholine

1 reference

based on heuristic

inferred from InChI

1-Palmitoyl-2-linoleoyl-sn-glycero-3-phosphocholin

1 reference

based on heuristic

inferred from InChI

chemical formula

C₄₂H₈₀NO₈P

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

CCCCCC=CCC=CCCCCCCCC(=O)OC(COC(=O)CCCCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C

1 reference

based on heuristic

inferred from isomeric SMILES

isomeric SMILES

[C@](COP(=O)([O-])OCC[N+](C)(C)C)([H])(OC(CCCCCCC/C=C/C/C=C/CCCCC)=O)COC(CCCCCCCCCCCCCCC)=O

0 references

Identifiers

InChI=1S/C42H80NO8P/c1-6-8-10-12-14-16-18-20-21-23-25-27-29-31-33-35-42(45)51-40(39-50-52(46,47)49-37-36-43(3,4)5)38-48-41(44)34-32-30-28-26-24-22-19-17-15-13-11-9-7-2/h14,16,20-21,40H,6-13,15,17-19,22-39H2,1-5H3/b16-14+,21-20+/t40-/m1/s1

1 reference

based on heuristic

inferred from SMILES

JLPULHDHAOZNQI-JLOPVYAASA-N

1 reference

based on heuristic

inferred from SMILES

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

JLPULHDHAOZNQI-JLOPVYAASA-N

mapping relation type

1 reference

matched by identifier from

International Chemical Identifier

InChI=1S/C42H80NO8P/c1-6-8-10-12-14-16-18-20-21-23-25-27-29-31-33-35-42(45)51-40(39-50-52(46,47)49-37-36-43(3,4)5)38-48-41(44)34-32-30-28-26-24-22-19-17-15-13-11-9-7-2/h14,16,20-21,40H,6-13,15,17-19,22-39H2,1-5H3/b16-14+,21-20+/t40-/m1/s1

UniChem compound ID

1 reference

0 references

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