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CL(20:4(5Z,8Z,11Z,14Z)/18:2(9Z,11Z)/18:2(9Z,11Z)/16:0)

Properties

Image

Occurences in reactions

MNX_ID

MNXM1112205

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

formula

C₈₁H₁₄₂O₁₇P₂

charge

mass

1448.97223

reference

hmdb:HMDB0111975

InChIKey

NIWZRRPBRGMTPR-JEIZZTSXSA-N

InChI

InChI=1S/C81H142O17P2/c1-5-9-13-17-21-25-29-33-36-37-40-43-46-50-54-58-62-66-79(84)92-72-77(98-81(86)68-64-60-56-52-48-44-39-35-31-27-23-19-15-11-7-3)74-96-100(89,90)94-70-75(82)69-93-99(87,88)95-73-76(97-80(85)67-63-59-55-51-47-41-32-28-24-20-16-12-8-4)71-91-78(83)65-61-57-53-49-45-42-38-34-30-26-22-18-14-10-6-2/h21,25-27,30-31,33-36,38-40,43,50,54,75-77,82H,5-20,22-24,28-29,32,37,41-42,44-49,51-53,55-74H2,1-4H3,(H,87,88)(H,89,90)/b25-21-,30-26-,31-27-,36-33-,38-34-,39-35-,43-40-,54-50-/t75-,76-,77-/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)CCCCCCC/C=C\C=C/CCCCCC)OC(=O)CCCCCCCCCCCCCCC)OC(=O)CCCCCCC/C=C\C=C/CCCCCC

Parent-child relations graph

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Similar chemical compounds in external resources
Identifier	Description
hmdb:HMDB0111975	CL(20:4(5Z,8Z,11Z,14Z)/18:2(9Z,11Z)/18:2(9Z,11Z)/16:0) (2R)-3-{[(2R)-2-(hexadecanoyloxy)-3-[(9Z,11Z)-octadeca-9,11-dienoyloxy]propoxy(hydroxy)phosphoryl]oxy}-2-hydroxypropoxy((2R)-3-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyloxy]-2-[(9Z,11Z)-octadeca-9,11-dienoyloxy]propoxy)phosphinic acid [(2R)-3-({[(2R)-2-(hexadecanoyloxy)-3-[(9Z,11Z)-octadeca-9,11-dienoyloxy]propoxy](hydroxy)phosphoryl}oxy)-2-hydroxypropoxy][(2R)-3-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyloxy]-2-[(9Z,11Z)-octadeca-9,11-dienoyloxy]propoxy]phosphinate [(2R)-3-({[(2R)-2-(hexadecanoyloxy)-3-[(9Z,11Z)-octadeca-9,11-dienoyloxy]propoxy](hydroxy)phosphoryl}oxy)-2-hydroxypropoxy][(2R)-3-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyloxy]-2-[(9Z,11Z)-octadeca-9,11-dienoyloxy]propoxy]phosphinic acid