(Q27127306)

CHEBI:60475 (English)

6 October 2016

chemical formula

C₄₂H₈₁NO₈P⁺

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCC[N+](C)(C)C)OC(=O)CCCCCCCC=CCC=CCCCCC

1 reference

CHEBI:60475 (English)

6 October 2016

isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)(O)OCC[N+](C)(C)C)O[14C](=O)CCCCCCC/C=C\C/C=C\CCCCC

1 reference

CHEBI:60475 (English)

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/p+1/b16-14-,21-20-/t40-/m1/s1/i42+2

6 October 2016

Identifiers

InChI

1 reference

CHEBI:60475 (English)

JLPULHDHAOZNQI-WFTBIWLKSA-O

6 October 2016

InChIKey

2 references

CHEBI:60475 (English)

6 October 2016

stated in

ChEBI release 2020-09-01

1 reference

(7R,17Z,20Z)-4-Hydroxy-N,N,N-trimethyl-9-oxo-7-[(palmitoyloxy)methyl](9-~14~C)-3,5,8-trioxa-4-phosphahexacosa-17,20-dien-1-aminium 4-oxide (English)

6 October 2016

1 reference

CHEBI:60475 (English)

6 October 2016

ChEBI ID

60475

mapping relation type

1 reference

Immune Epitope Database and Analysis Resource

1-O-palmitoyl-2-O-[1-(14)C]-linoleoyl-sn-glycero-3-phosphocholine (English)

6 October 2016

1 reference

1 reference

IEDB Epitope ID

140954