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PA(17:1(9Z)/20:4(5Z,8Z,11Z,14Z))

PropertiesImage
MNX_IDMNXM66584 Image of MNXM66584
referencelipidmapsM:LMGP10010268
formulaC40H69O8P
global charge0
mol weight708.958
InChIKeyMKQUDAHREQNJKB-ORIMTMQRSA-N
InChIInChI=1S/C40H69O8P/c1-3-5-7-9-11-13-15-17-19-20-21-23-25-27-29-31-33-35-40(42)48-38(37-47-49(43,44)45)36-46-39(41)34-32-30-28-26-24-22-18-16-14-12-10-8-6-4-2/h11,13,16-19,21,23,27,29,38H,3-10,12,14-15,20,22,24-26,28,30-37H2,1-2H3,(H2,43,44,45)/b13-11-,18-16-,19-17-,23-21-,29-27-/t38-/m1/s1
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)O[C@H](COC(=O)CCCCCCC/C=C\CCCCCCC)COP(=O)(O)O
MNX internals
InChI (mnx)InChI=1/C40H69O8P/c1-3-5-7-9-11-13-15-17-19-20-21-23-25-27-29-31-33-35-40(42)48-38(37-47-49(43,44)45)36-46-39(41)34-32-30-28-26-24-22-18-16-14-12-10-8-6-4-2/h11,13,16-19,21,23,27,29,38H,3-10,12,14-15,20,22,24-26,28,30-37H2,1-2H3,(H2,43,44,45)/b13-11-,18-16-,19-17-,23-21-,29-27-/t38-/m1/s1 Image of MNXM66584
SMILES (mnx)[CH3:1][CH2:3][CH2:5][CH2:7][CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:17]=[CH:19]\[CH2:20]/[CH:21]=[CH:23]\[CH2:25]/[CH:27]=[CH:29]\[CH2:31][CH2:33][CH2:35][C:40](=[O:42])[O:48][C@H:38]([CH2:36][O:46][C:39]([CH2:34][CH2:32][CH2:30][CH2:28][CH2:26][CH2:24][CH2:22]/[CH:18]=[CH:16]\[CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:41])[CH2:37][O:47][P:49]([OH:43])([OH:44])=[O:45]
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

lipidmaps:LMGP10010268
lipidmapsM:LMGP10010268
MKQUDAHREQNJKB-ORIMTMQRSA-N
PA(17:1(9Z)/20:4(5Z,8Z,11Z,14Z))
1-(9Z-heptadecenoyl)-2-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-glycero-3-phosphate
PA 37:5
PA(17:1_20:4)
PA(37:5)