1-hexadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) (Q27140180)

CHEBI:72840 (English)

7 October 2016

chemical formula

C₄₀H₇₄O₁₀P⁻

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC(CO)O)OC(=O)CCCCCCCC=CCC=CCCCCC

1 reference

CHEBI:72840 (English)

7 October 2016

isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OC[C@H](CO)O)OC(=O)CCCCCCC/C=C\C/C=C\CCCCC

1 reference

CHEBI:72840 (English)

InChI=1S/C40H75O10P/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-40(44)50-38(36-49-51(45,46)48-34-37(42)33-41)35-47-39(43)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h11,13,17-18,37-38,41-42H,3-10,12,14-16,19-36H2,1-2H3,(H,45,46)/p-1/b13-11-,18-17-/t37-,38+/m0/s1

7 October 2016

Identifiers

InChI

1 reference

CHEBI:72840 (English)

ATBOMIWRCZXYSZ-WLGRLVTESA-M

7 October 2016

InChIKey

2 references

CHEBI:72840 (English)

7 October 2016

stated in

ChEBI release 2020-09-01

1 reference

(2S)-2,3-Dihydroxypropyl (2R)-2-[(9Z,12Z)-9,12-octadecadienoyloxy]-3-(palmitoyloxy)propyl phosphatato (English)

7 October 2016

1 reference

CHEBI:72840 (English)

7 October 2016

ChEBI ID

72840

mapping relation type

1 reference

https://www.swisslipids.org/#/downloads

1-hexadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) (English)

7 October 2016

1 reference

1 reference