(Q76956705)

English

1-Linoleoyl-2-myristoyl-3-adrenoyl-glycerol

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

1-linoleoyl-2-acylglycerolipid

1 reference

based on heuristic

inferred from SMILES

mass

878.736340856 dalton

1 reference

based on heuristic

inferred from isomeric SMILES

chemical formula

C₅₇H₉₈O₆

0 references

canonical SMILES

CCCCCC=CCC=CCC=CCC=CCCCCCC(=O)OCC(COC(=O)CCCCCCCC=CCC=CCCCCC)OC(=O)CCCCCCCCCCCCC

1 reference

based on heuristic

inferred from isomeric SMILES

isomeric SMILES

CCCCCCCCCCCCCC(=O)O[C@@H](COC(=O)CCCCCCC/C=C\C/C=C\CCCCC)COC(=O)CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC

0 references

Identifiers

InChI

InChI=1S/C57H98O6/c1-4-7-10-13-16-19-22-24-26-27-28-29-31-33-36-38-41-44-47-50-56(59)62-53-54(63-57(60)51-48-45-42-39-34-21-18-15-12-9-6-3)52-61-55(58)49-46-43-40-37-35-32-30-25-23-20-17-14-11-8-5-2/h16-17,19-20,24-26,28-30,33,36,54H,4-15,18,21-23,27,31-32,34-35,37-53H2,1-3H3/b19-16-,20-17-,26-24-,29-28-,30-25-,36-33-/t54-/m0/s1

0 references

InChIKey

GKTKNWIZYRFBBZ-PRHWSHMVSA-N

0 references

PubChem CID

131763091

1 reference

matched by identifier from

InChIKey

GKTKNWIZYRFBBZ-PRHWSHMVSA-N

1 reference

Human Metabolome Database ID

HMDB0052402

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

GKTKNWIZYRFBBZ-PRHWSHMVSA-N

2 references

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

retrieved

6 November 2021

matched by identifier from

InChIKey

GKTKNWIZYRFBBZ-PRHWSHMVSA-N

(Q76956705)

1-Linoleoyl-2-myristoyl-3-adrenoyl-glycerol

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