(Q76394785)

English

1-hexadecanoyl-2,3-di-(9Z,12Z,15Z-octadecatrienoyl)-sn-glycerol

chemical compound

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instance of

type of chemical entity

0 references

subclass of

1-alpha-linolenoyl 2-acylglycerolipid

1 reference

based on heuristic

inferred from SMILES

mass

850.705040728 dalton

1 reference

based on heuristic

inferred from isomeric SMILES

chemical formula

C₅₅H₉₄O₆

0 references

canonical SMILES

CCC=CCC=CCC=CCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCC)OC(=O)CCCCCCCC=CCC=CCC=CCC

1 reference

based on heuristic

inferred from isomeric SMILES

isomeric SMILES

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

0 references

Identifiers

InChI

InChI=1S/C55H94O6/c1-4-7-10-13-16-19-22-25-27-30-33-36-39-42-45-48-54(57)60-51-52(50-59-53(56)47-44-41-38-35-32-29-24-21-18-15-12-9-6-3)61-55(58)49-46-43-40-37-34-31-28-26-23-20-17-14-11-8-5-2/h7-8,10-11,16-17,19-20,25-28,52H,4-6,9,12-15,18,21-24,29-51H2,1-3H3/b10-7-,11-8-,19-16-,20-17-,27-25-,28-26-/t52-/m1/s1

0 references

InChIKey

GLKWVCJIQVMKME-SQBPNMLSSA-N

0 references

PubChem CID

9544157

1 reference

matched by identifier from

InChIKey

GLKWVCJIQVMKME-SQBPNMLSSA-N

1 reference

1 reference

1 reference

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

30 June 2018

2 references

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

retrieved

6 November 2021

matched by identifier from

InChIKey

GLKWVCJIQVMKME-SQBPNMLSSA-N

(Q76394785)

1-hexadecanoyl-2,3-di-(9Z,12Z,15Z-octadecatrienoyl)-sn-glycerol

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