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1-(10Z,13Z,16Z,19Z,22Z-octacosapentaenoyl)-2-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-sn-glycero-3-phosphate

PropertiesImage
MNX_IDMNXM181281 Image of MNXM181281
referenceslm:000020892
formulaC51H81O8P
global charge-2
mol weight853.175
InChIKeyQTFALNQATHJNRU-KOZSEADHSA-L
InChIInChI=1S/C51H83O8P/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-25-26-27-28-30-31-33-35-37-39-41-43-45-50(52)57-47-49(48-58-60(54,55)56)59-51(53)46-44-42-40-38-36-34-32-29-20-18-16-14-12-10-8-6-4-2/h11-14,17-20,22-23,25-26,28,30,32,34,38,40,49H,3-10,15-16,21,24,27,29,31,33,35-37,39,41-48H2,1-2H3,(H2,54,55,56)/p-2/b13-11-,14-12-,19-17-,20-18-,23-22-,26-25-,30-28-,34-32-,40-38-/t49-/m1/s1
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCC(=O)OC[C@H](COP(=O)([O-])[O-])OC(=O)CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC
MNX internals
InChI (mnx)InChI=1/C51H83O8P/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-25-26-27-28-30-31-33-35-37-39-41-43-45-50(52)57-47-49(48-58-60(54,55)56)59-51(53)46-44-42-40-38-36-34-32-29-20-18-16-14-12-10-8-6-4-2/h11-14,17-20,22-23,25-26,28,30,32,34,38,40,49H,3-10,15-16,21,24,27,29,31,33,35-37,39,41-48H2,1-2H3,(H2,54,55,56)/b13-11-,14-12-,19-17-,20-18-,23-22-,26-25-,30-28-,34-32-,40-38-/t49-/m1/s1 Image of MNXM181281
SMILES (mnx)[CH3:1][CH2:3][CH2:5][CH2:7][CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:17]=[CH:19]\[CH2:21]/[CH:22]=[CH:23]\[CH2:24]/[CH:25]=[CH:26]\[CH2:27]/[CH:28]=[CH:30]\[CH2:31][CH2:33][CH2:35][CH2:37][CH2:39][CH2:41][CH2:43][CH2:45][C:50](=[O:52])[O:57][CH2:47][C@H:49]([CH2:48][O:58][P:60]([OH:54])([OH:55])=[O:56])[O:59][C:51]([CH2:46][CH2:44][CH2:42]/[CH:40]=[CH:38]\[CH2:36]/[CH:34]=[CH:32]\[CH2:29]/[CH:20]=[CH:18]\[CH2:16]/[CH:14]=[CH:12]\[CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:53]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

SLM:000020892
slm:000020892
QTFALNQATHJNRU-KOZSEADHSA-L
1-(10Z,13Z,16Z,19Z,22Z-octacosapentaenoyl)-2-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-sn-glycero-3-phosphate
PA(28:5(10Z,13Z,16Z,19Z,22Z)/20:4(5Z,8Z,11Z,14Z))
Phosphatidate (28:5(10Z,13Z,16Z,19Z,22Z)/20:4(5Z,8Z,11Z,14Z))