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1-(11Z,14Z,17Z-eicoastrienoyl)-2-(13Z,16Z,19Z,22Z-octacosatetraenoyl)-sn-glycero-3-phosphate

PropertiesImage
MNX_IDMNXM196101 Image of MNXM196101
referenceslm:000021344
formulaC51H85O8P
global charge-2
mol weight857.207
InChIKeyFOXVJOSVEAFKPQ-XUDZEYHLSA-L
InChIInChI=1S/C51H87O8P/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-25-26-27-28-30-32-34-36-38-40-42-44-46-51(53)59-49(48-58-60(54,55)56)47-57-50(52)45-43-41-39-37-35-33-31-29-20-18-16-14-12-10-8-6-4-2/h6,8,11-14,17-20,22-23,25-26,49H,3-5,7,9-10,15-16,21,24,27-48H2,1-2H3,(H2,54,55,56)/p-2/b8-6-,13-11-,14-12-,19-17-,20-18-,23-22-,26-25-/t49-/m1/s1
SMILESCC/C=C\C/C=C\C/C=C\CCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])[O-])OC(=O)CCCCCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC
MNX internals
InChI (mnx)InChI=1/C51H87O8P/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-25-26-27-28-30-32-34-36-38-40-42-44-46-51(53)59-49(48-58-60(54,55)56)47-57-50(52)45-43-41-39-37-35-33-31-29-20-18-16-14-12-10-8-6-4-2/h6,8,11-14,17-20,22-23,25-26,49H,3-5,7,9-10,15-16,21,24,27-48H2,1-2H3,(H2,54,55,56)/b8-6-,13-11-,14-12-,19-17-,20-18-,23-22-,26-25-/t49-/m1/s1 Image of MNXM196101
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][CH2:28][CH2:30][CH2:32][CH2:34][CH2:36][CH2:38][CH2:40][CH2:42][CH2:44][CH2:46][C:51](=[O:53])[O:59][C@H:49]([CH2:47][O:57][C:50]([CH2:45][CH2:43][CH2:41][CH2:39][CH2:37][CH2:35][CH2:33][CH2:31][CH2:29]/[CH:20]=[CH:18]\[CH2:16]/[CH:14]=[CH:12]\[CH2:10]/[CH:8]=[CH:6]\[CH2:4][CH3:2])=[O:52])[CH2:48][O:58][P:60]([OH:54])([OH:55])=[O:56]
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:000021344
slm:000021344
FOXVJOSVEAFKPQ-XUDZEYHLSA-L
1-(11Z,14Z,17Z-eicoastrienoyl)-2-(13Z,16Z,19Z,22Z-octacosatetraenoyl)-sn-glycero-3-phosphate
PA(20:3(11Z,14Z,17Z)/28:4(13Z,16Z,19Z,22Z))
Phosphatidate (20:3(11Z,14Z,17Z)/28:4(13Z,16Z,19Z,22Z))