(Q105343151)

inferred from SMILES

chemical formula

C₈₁H₁₅₈O₁₇P₂

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canonical SMILES

O=C(OCC(OC(=O)CCCCCCCCCCCCCCCCC)COP(=O)(O)OCC(O)COP(=O)(O)OCC(OC(=O)CCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCC

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isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)(O)OCC(O)COP(=O)(O)OC[C@@H](COC(=O)CCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCC

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found in taxon

Alchemilla pentaphyllea

1 reference

Polar lipid composition of leaves from nine typical alpine species

Androsace helvetica

1 reference

Polar lipid composition of leaves from nine typical alpine species

Geum reptans

1 reference

Polar lipid composition of leaves from nine typical alpine species

Ranunculus glacialis

1 reference

Polar lipid composition of leaves from nine typical alpine species

Salix herbacea

1 reference

Polar lipid composition of leaves from nine typical alpine species

Salix reticulata

1 reference

Polar lipid composition of leaves from nine typical alpine species

Salix retusa

1 reference

Polar lipid composition of leaves from nine typical alpine species

Saussurea depressa

1 reference

Polar lipid composition of leaves from nine typical alpine species

Carex myosuroides

1 reference

Polar lipid composition of leaves from nine typical alpine species

Carex capillifolia

1 reference

Polar lipid composition of leaves from nine typical alpine species

Identifiers

InChI

InChI=1S/C81H158O17P2/c1-5-9-13-17-21-25-29-33-37-41-45-49-53-57-61-65-78(83)91-71-76(97-80(85)67-63-59-55-51-47-43-39-35-31-27-23-19-15-11-7-3)73-95-99(87,88)93-69-75(82)70-94-100(89,90)96-74-77(98-81(86)68-64-60-56-52-48-44-40-36-32-28-24-20-16-12-8-4)72-92-79(84)66-62-58-54-50-46-42-38-34-30-26-22-18-14-10-6-2/h75-77,82H,5-74H2,1-4H3,(H,87,88)(H,89,90)/t76-,77-/m1/s1

0 references

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1 reference

17 September 2022

ChEBI ID

62861

mapping relation type

exact match

2 references

ChEBI release 2021-03-01

International Chemical Identifier

InChI

InChI=1S/C81H158O17P2/c1-5-9-13-17-21-25-29-33-37-41-45-49-53-57-61-65-78(83)91-71-76(97-80(85)67-63-59-55-51-47-43-39-35-31-27-23-19-15-11-7-3)73-95-99(87,88)93-69-75(82)70-94-100(89,90)96-74-77(98-81(86)68-64-60-56-52-48-44-40-36-32-28-24-20-16-12-8-4)72-92-79(84)66-62-58-54-50-46-42-38-34-30-26-22-18-14-10-6-2/h75-77,82H,5-74H2,1-4H3,(H,87,88)(H,89,90)/t76-,77-/m1/s1

SureChEMBL ID

SCHEMBL26881109

2 references

SCHEMBL40385

2 references

1 reference

1 reference

1 reference

Human Metabolome Database ID

HMDB0056960

2 references

0 references

1 reference

http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download

17 April 2021

IEDB Epitope ID

161168

1 reference