(Q76395358)

English

[(2S)-3-[(Z)-heptadec-9-enoyl]oxy-2-octadecanoyloxypropyl] docosanoate

chemical compound

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instance of

type of chemical entity

0 references

subclass of

1-stearoyl 2-acylglycerolipid

1 reference

based on heuristic

inferred from SMILES

mass

930.861541368 dalton

1 reference

based on heuristic

inferred from isomeric SMILES

chemical formula

C₆₀H₁₁₄O₆

0 references

canonical SMILES

CCCCCCCC=CCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCC

1 reference

based on heuristic

inferred from isomeric SMILES

isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC(=O)OC[C@@H](COC(=O)CCCCCCC/C=C\CCCCCCC)OC(=O)CCCCCCCCCCCCCCCCC

0 references

Identifiers

InChI

InChI=1S/C60H114O6/c1-4-7-10-13-16-19-22-25-28-29-30-31-33-35-38-41-44-47-50-53-59(62)65-56-57(55-64-58(61)52-49-46-43-40-37-34-27-24-21-18-15-12-9-6-3)66-60(63)54-51-48-45-42-39-36-32-26-23-20-17-14-11-8-5-2/h24,27,57H,4-23,25-26,28-56H2,1-3H3/b27-24-/t57-/m1/s1

0 references

InChIKey

GGINZASHAMQHAX-QEBBQXNSSA-N

0 references

PubChem CID

9544592

1 reference

matched by identifier from

InChIKey

GGINZASHAMQHAX-QEBBQXNSSA-N

1 reference

1 reference

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

retrieved

30 June 2018

(Q76395358)

[(2S)-3-[(Z)-heptadec-9-enoyl]oxy-2-octadecanoyloxypropyl] docosanoate

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