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CL(1'-[16:0/16:0],3'-[20:4(5Z,8Z,11Z,14Z)/18:1(9Z)])

Properties

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Occurences in reactions

MNX_ID

MNXM1105177

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

formula

C₇₉H₁₄₄O₁₇P₂

charge

mass

1426.98788

reference

lipidmapsM:LMGP12010039

InChIKey

QSSSMCXDGWQLTN-ZMLIYOKISA-N

InChI

InChI=1S/C79H144O17P2/c1-5-9-13-17-21-25-29-33-35-36-38-41-44-48-52-56-60-64-77(82)90-70-75(96-79(84)66-62-58-54-50-46-42-37-34-30-26-22-18-14-10-6-2)72-94-98(87,88)92-68-73(80)67-91-97(85,86)93-71-74(95-78(83)65-61-57-53-49-45-40-32-28-24-20-16-12-8-4)69-89-76(81)63-59-55-51-47-43-39-31-27-23-19-15-11-7-3/h21,25,33-35,37-38,41,48,52,73-75,80H,5-20,22-24,26-32,36,39-40,42-47,49-51,53-72H2,1-4H3,(H,85,86)(H,87,88)/b25-21-,35-33-,37-34-,41-38-,52-48-/t73-,74-,75-/m1/s1

SMILES

CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)OC[C@H](COP(=O)(O)OC[C@H](O)COP(=O)(O)OC[C@@H](COC(=O)CCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCC)OC(=O)CCCCCCC/C=C\CCCCCCCC

Parent-child relations graph

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Similar chemical compounds in external resources
Identifier	Description
lipidmaps:LMGP12010039 lipidmapsM:LMGP12010039	CL(1'-[16:0/16:0],3'-[20:4(5Z,8Z,11Z,14Z)/18:1(9Z)]) 1'-[1,2-dihexadecanoyl-sn-glycero-3-phospho],3'-[1-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-2-(9Z-octadecenoyl)-sn-glycero-3-phospho]-sn-glycerol CL 70:5 CL(16:0_16:0_18:1_20:4) CL(70:5)
hmdb:HMDB0111930	CL(20:4(5Z,8Z,11Z,14Z)/18:1(9Z)/16:0/16:0) (2R)-3-{[(2R)-2,3-bis(hexadecanoyloxy)propoxy(hydroxy)phosphoryl]oxy}-2-hydroxypropoxy((2R)-3-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyloxy]-2-[(9Z)-octadec-9-enoyloxy]propoxy)phosphinic acid [(2R)-3-({[(2R)-2,3-bis(hexadecanoyloxy)propoxy](hydroxy)phosphoryl}oxy)-2-hydroxypropoxy][(2R)-3-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyloxy]-2-[(9Z)-octadec-9-enoyloxy]propoxy]phosphinic acid