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1-heneicosanoyl-2-(7Z,10Z,13Z,16Z,19Z-docosapentaenoyl)-sn-glycero-3-phosphate

PropertiesImage
MNX_IDMNXM358040 Image of MNXM358040
referenceslm:000026015
formulaC46H79O8P
global charge-2
mol weight791.104
InChIKeyULJUVIGZQMHRHJ-OZDBTGSISA-L
InChIInChI=1S/C46H81O8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-46(48)54-44(43-53-55(49,50)51)42-52-45(47)40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5,7,11,13,17,19,23,25,29,31,44H,3-4,6,8-10,12,14-16,18,20-22,24,26-28,30,32-43H2,1-2H3,(H2,49,50,51)/p-2/b7-5-,13-11-,19-17-,25-23-,31-29-/t44-/m1/s1
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCCCCCCC)COP(=O)([O-])[O-]
MNX internals
InChI (mnx)InChI=1/C46H81O8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-46(48)54-44(43-53-55(49,50)51)42-52-45(47)40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5,7,11,13,17,19,23,25,29,31,44H,3-4,6,8-10,12,14-16,18,20-22,24,26-28,30,32-43H2,1-2H3,(H2,49,50,51)/b7-5-,13-11-,19-17-,25-23-,31-29-/t44-/m1/s1 Image of MNXM358040
SMILES (mnx)[CH3:1][CH2:3]/[CH:5]=[CH:7]\[CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:17]=[CH:19]\[CH2:21]/[CH:23]=[CH:25]\[CH2:27]/[CH:29]=[CH:31]\[CH2:33][CH2:35][CH2:37][CH2:39][CH2:41][C:46](=[O:48])[O:54][C@H:44]([CH2:42][O:52][C:45]([CH2:40][CH2:38][CH2:36][CH2:34][CH2:32][CH2:30][CH2:28][CH2:26][CH2:24][CH2:22][CH2:20][CH2:18][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:47])[CH2:43][O:53][P:55]([OH:49])([OH:50])=[O:51]
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:000026015
slm:000026015
ULJUVIGZQMHRHJ-OZDBTGSISA-L
1-heneicosanoyl-2-(7Z,10Z,13Z,16Z,19Z-docosapentaenoyl)-sn-glycero-3-phosphate
PA(21:0/22:5(7Z,10Z,13Z,16Z,19Z))
Phosphatidate (21:0/22:5(7Z,10Z,13Z,16Z,19Z))