tritrans,heptacis-undecaprenyl phosphate(2-) (Q27139073)

inferred from isomeric SMILES

1 February 2021

mass

844.65094511782 dalton

1 reference

based on heuristic

chemical formula

C₅₅H₈₉O₄P²⁻

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

CC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCOP(=O)([O-])[O-])C)C)C)C)C)C)C)C)C)C)C

1 reference

CHEBI:70763 (English)

7 October 2016

isomeric SMILES

CC(=CCC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C\CC/C(=C\CC/C(=C\CC/C(=C\CC/C(=C\CC/C(=C\CC/C(=C\COP(=O)([O-])[O-])/C)/C)/C)/C)/C)/C)/C)/C)/C)/C)C

1 reference

CHEBI:70763 (English)

InChI=1S/C55H91O4P/c1-45(2)23-13-24-46(3)25-14-26-47(4)27-15-28-48(5)29-16-30-49(6)31-17-32-50(7)33-18-34-51(8)35-19-36-52(9)37-20-38-53(10)39-21-40-54(11)41-22-42-55(12)43-44-59-60(56,57)58/h23,25,27,29,31,33,35,37,39,41,43H,13-22,24,26,28,30,32,34,36,38,40,42,44H2,1-12H3,(H2,56,57,58)/p-2/b46-25+,47-27+,48-29+,49-31-,50-33-,51-35-,52-37-,53-39-,54-41-,55-43-

7 October 2016

Identifiers

InChI

1 reference

CHEBI:70763 (English)

UFPHFKCTOZIAFY-RTRZQXHFSA-L

7 October 2016

InChIKey

2 references

CHEBI:70763 (English)

7 October 2016

stated in

ChEBI release 2020-09-01

1 reference

(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30E,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-Undecamethyl-2,6,10,14,18,22,26,30,34,38,42-tetratetracontaundecaen-1-yl phosphate (English)

7 October 2016

1 reference