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1-(13-methyltetradecanoyl)-2-(11Z-octadecenoyl)-sn-glycero-3-phosphocholine

PropertiesImage
MNX_IDMNXM212538 Image of MNXM212538
referenceslm:000008798
formulaC41H80NO8P
global charge0
mol weight746.064
InChIKeyGTNXYSGGNBJFSF-VPLLVUDMSA-N
InChIInChI=1S/C41H80NO8P/c1-7-8-9-10-11-12-13-14-15-16-17-20-24-27-30-33-41(44)50-39(37-49-51(45,46)48-35-34-42(4,5)6)36-47-40(43)32-29-26-23-21-18-19-22-25-28-31-38(2)3/h12-13,38-39H,7-11,14-37H2,1-6H3/b13-12-/t39-/m1/s1
SMILESCCCCCC/C=C\CCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCC(C)C)COP(=O)([O-])OCC[N+](C)(C)C
MNX internals
InChI (mnx)InChI=1/C41H80NO8P/c1-7-8-9-10-11-12-13-14-15-16-17-20-24-27-30-33-41(44)50-39(37-49-51(45,46)48-35-34-42(4,5)6)36-47-40(43)32-29-26-23-21-18-19-22-25-28-31-38(2)3/h12-13,38-39H,7-11,14-37H2,1-6H3/b13-12-/t39-/m1/s1 Image of MNXM212538
SMILES (mnx)[CH3:1][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11]/[CH:12]=[CH:13]\[CH2:14][CH2:15][CH2:16][CH2:17][CH2:20][CH2:24][CH2:27][CH2:30][CH2:33][C:41](=[O:44])[O:50][C@H:39]([CH2:36][O:47][C:40]([CH2:32][CH2:29][CH2:26][CH2:23][CH2:21][CH2:18][CH2:19][CH2:22][CH2:25][CH2:28][CH2:31][CH:38]([CH3:2])[CH3:3])=[O:43])[CH2:37][O:49][P:51](=[O:45])([O-:46])[O:48][CH2:35][CH2:34][N+:42]([CH3:4])([CH3:5])[CH3:6]
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:000008798
slm:000008798
GTNXYSGGNBJFSF-VPLLVUDMSA-N
1-(13-methyltetradecanoyl)-2-(11Z-octadecenoyl)-sn-glycero-3-phosphocholine
PC(15:0/18:1(11Z))
Phosphatidylcholine (15:0/18:1(11Z))