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1-hexadecanoyl-2-(9Z)-octadecenoyl-3-octadecanoyl-sn-glycerol

Properties

Image

Occurences in reactions

MNX_ID

MNXM133746

	#reac
in my sandbox	0
in MNXref (generic)	5
in models (compartimentalized)	3

formula

C₅₅H₁₀₄O₆

charge

mass

860.78329

reference

chebi:77623

InChIKey

QXPXMOHHFYONAC-FEKLXSIDSA-N

InChI

InChI=1S/C55H104O6/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/h26,28,52H,4-25,27,29-51H2,1-3H3/b28-26-/t52-/m1/s1

SMILES

CCCCCCCC/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:77623 chebi:77623	1-hexadecanoyl-2-(9Z)-octadecenoyl-3-octadecanoyl-sn-glycerol 1-(hexadecanyloxy)-3-(octadecanoyloxy)propan-2-yl (9Z)-octadec-9-enoate 1-(palmitoyloxy)-3-(stearoyloxy)propan-2-yl (9Z)-octadec-9-enoate 1-Hexadecanoyl-2-(9Z-octadecenoyl)-3-octadecanoylglycerol 1-Palmitoyl-2-oleoyl-3-stearoylglycerol 1-palmitoyl-2-oleoyl-3-stearoyl-sn-glycerol Glycerol 1-octadecanoate 2-(9Z-octadecenoate) 3-hexadecanoate TAG(52:1) TG(16:0/18:1(9Z)/18:0) TG(16:0/18:1/18:0) TG(52:1) Triacylglycerol(16:0/18:1/18:0) Triacylglycerol(52:1)
SLM:000159783 slm:000159783	1-hexadecanoyl-2-(9Z-octadecenoyl)-3-octadecanoyl-sn-glycerol TG(16:0/18:1(9Z)/18:0) Triacylglycerol (16:0/18:1(9Z)/18:0)
bigg.metabolite:tag1601819Z180 biggM:tag1601819Z180 seed.compound:cpd30570 seedM:cpd30570	Triacylglycerol (16:0/18:1(9Z)/18:0)
biggM:M_tag1601819Z180 seedM:M_cpd30570	secondary/obsolete/fantasy identifier