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1-(11Z-eicosenoyl)-2-tridecanoyl-sn-glycero-3-phosphocholine

PropertiesImage
MNX_IDMNXM70010 Image of MNXM70010
referenceslm:000008550
formulaC41H80NO8P
global charge0
mol weight746.064
InChIKeyFOVVQGVAJUZWET-DPTAKULKSA-N
InChIInChI=1S/C41H80NO8P/c1-6-8-10-12-14-16-18-19-20-21-22-23-24-26-27-29-31-33-40(43)47-37-39(38-49-51(45,46)48-36-35-42(3,4)5)50-41(44)34-32-30-28-25-17-15-13-11-9-7-2/h19-20,39H,6-18,21-38H2,1-5H3/b20-19-/t39-/m1/s1
SMILESCCCCCCCC/C=C\CCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C41H80NO8P/c1-6-8-10-12-14-16-18-19-20-21-22-23-24-26-27-29-31-33-40(43)47-37-39(38-49-51(45,46)48-36-35-42(3,4)5)50-41(44)34-32-30-28-25-17-15-13-11-9-7-2/h19-20,39H,6-18,21-38H2,1-5H3/b20-19-/t39-/m1/s1 Image of MNXM70010
SMILES (mnx)[CH3:1][CH2:6][CH2:8][CH2:10][CH2:12][CH2:14][CH2:16][CH2:18]/[CH:19]=[CH:20]\[CH2:21][CH2:22][CH2:23][CH2:24][CH2:26][CH2:27][CH2:29][CH2:31][CH2:33][C:40](=[O:43])[O:47][CH2:37][C@H:39]([CH2:38][O:49][P:51](=[O:45])([O-:46])[O:48][CH2:36][CH2:35][N+:42]([CH3:3])([CH3:4])[CH3:5])[O:50][C:41]([CH2:34][CH2:32][CH2:30][CH2:28][CH2:25][CH2:17][CH2:15][CH2:13][CH2:11][CH2:9][CH2:7][CH3:2])=[O:44]
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:000008550
slm:000008550
FOVVQGVAJUZWET-DPTAKULKSA-N
1-(11Z-eicosenoyl)-2-tridecanoyl-sn-glycero-3-phosphocholine
PC(20:1(11Z)/13:0)
Phosphatidylcholine (20:1(11Z)/13:0)

lipidmaps:LMGP01011806
lipidmapsM:LMGP01011806
FOVVQGVAJUZWET-DPTAKULKSA-N
PC(20:1(11Z)/13:0)
1-(11Z-eicosenoyl)-2-tridecanoyl-glycero-3-phosphocholine
PC 33:1
PC(13:0_20:1)
PC(33:1)