(Q76947784)

English

1-Palmitoleoyl-2-docosahexaenoyl-3-oleoyl-glycerol

chemical compound

In more languages

Statements

type of chemical entity

0 references

1-oleoyl-2-acylglycerolipid

1 reference

based on heuristic

inferred from SMILES

902.736340856 dalton

1 reference

based on heuristic

inferred from isomeric SMILES

chemical formula

C₅₉H₉₈O₆

0 references

canonical SMILES

CCC=CCC=CCC=CCC=CCC=CCC=CCCC(=O)OC(COC(=O)CCCCCCCC=CCCCCCC)COC(=O)CCCCCCCC=CCCCCCCCC

1 reference

based on heuristic

inferred from isomeric SMILES

isomeric SMILES

CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@H](COC(=O)CCCCCCC/C=C\CCCCCC)OC(=O)CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC

0 references

Identifiers

InChI=1S/C59H98O6/c1-4-7-10-13-16-19-22-25-27-28-29-30-32-35-38-41-44-47-50-53-59(62)65-56(54-63-57(60)51-48-45-42-39-36-33-24-21-18-15-12-9-6-3)55-64-58(61)52-49-46-43-40-37-34-31-26-23-20-17-14-11-8-5-2/h7,10,16,19,21,24-27,29-31,35,38,44,47,56H,4-6,8-9,11-15,17-18,20,22-23,28,32-34,36-37,39-43,45-46,48-55H2,1-3H3/b10-7-,19-16-,24-21-,27-25-,30-29-,31-26-,38-35-,47-44-/t56-/m0/s1

0 references

INFCNCPHUCNHIK-RLBGNLGOSA-N

0 references

1 reference

matched by identifier from

INFCNCPHUCNHIK-RLBGNLGOSA-N

UniChem compound ID

1 reference

Human Metabolome Database ID

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

INFCNCPHUCNHIK-RLBGNLGOSA-N

2 references

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

6 November 2021

matched by identifier from

INFCNCPHUCNHIK-RLBGNLGOSA-N

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