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1-(15Z,18Z,21Z,24Z-triacontatetraenoyl)-2-octanoyl-sn-glycero-3-phosphoethanolamine

PropertiesImage
MNX_IDMNXM233341 Image of MNXM233341
referenceslm:000031911
formulaC43H78NO8P
global charge0
mol weight768.07
InChIKeyIYBDMLWISVCVRA-CAXTWTNKSA-N
InChIInChI=1S/C43H78NO8P/c1-3-5-7-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-32-33-35-42(45)49-39-41(40-51-53(47,48)50-38-37-44)52-43(46)36-34-31-8-6-4-2/h10-11,13-14,16-17,19-20,41H,3-9,12,15,18,21-40,44H2,1-2H3,(H,47,48)/b11-10-,14-13-,17-16-,20-19-/t41-/m1/s1
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[NH3+])OC(=O)CCCCCCC
MNX internals
InChI (mnx)InChI=1/C43H78NO8P/c1-3-5-7-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-32-33-35-42(45)49-39-41(40-51-53(47,48)50-38-37-44)52-43(46)36-34-31-8-6-4-2/h10-11,13-14,16-17,19-20,41H,3-9,12,15,18,21-40,44H2,1-2H3,(H,47,48)/b11-10-,14-13-,17-16-,20-19-/t41-/m1/s1 Image of MNXM233341
SMILES (mnx)[CH3:1][CH2:3][CH2:5][CH2:7][CH2:9]/[CH:10]=[CH:11]\[CH2:12]/[CH:13]=[CH:14]\[CH2:15]/[CH:16]=[CH:17]\[CH2:18]/[CH:19]=[CH:20]\[CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:32][CH2:33][CH2:35][C:42](=[O:45])[O:49][CH2:39][C@H:41]([CH2:40][O:51][P:53]([OH:47])(=[O:48])[O:50][CH2:38][CH2:37][NH2:44])[O:52][C:43]([CH2:36][CH2:34][CH2:31][CH2:8][CH2:6][CH2:4][CH3:2])=[O:46]
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:000031911
slm:000031911
IYBDMLWISVCVRA-CAXTWTNKSA-N
1-(15Z,18Z,21Z,24Z-triacontatetraenoyl)-2-octanoyl-sn-glycero-3-phosphoethanolamine
PE(30:4(15Z,18Z,21Z,24Z)/8:0)
Phosphatidylethanolamine (30:4(15Z,18Z,21Z,24Z)/8:0)