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1-heneicosanoyl-2-(9Z-tetradecenoyl)-sn-glycero-3-phosphocholine

PropertiesImage
MNX_IDMNXM70305 Image of MNXM70305
referenceslm:000013027
formulaC43H84NO8P
global charge0
mol weight774.118
InChIKeyJLMJHJHQZIEXTR-XTSQRIEGSA-N
InChIInChI=1S/C43H84NO8P/c1-6-8-10-12-14-16-18-19-20-21-22-23-24-26-27-29-31-33-35-42(45)49-39-41(40-51-53(47,48)50-38-37-44(3,4)5)52-43(46)36-34-32-30-28-25-17-15-13-11-9-7-2/h13,15,41H,6-12,14,16-40H2,1-5H3/b15-13-/t41-/m1/s1
SMILESCCCC/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C
MNX internals
InChI (mnx)InChI=1/C43H84NO8P/c1-6-8-10-12-14-16-18-19-20-21-22-23-24-26-27-29-31-33-35-42(45)49-39-41(40-51-53(47,48)50-38-37-44(3,4)5)52-43(46)36-34-32-30-28-25-17-15-13-11-9-7-2/h13,15,41H,6-12,14,16-40H2,1-5H3/b15-13-/t41-/m1/s1 Image of MNXM70305
SMILES (mnx)[CH3:1][CH2:6][CH2:8][CH2:10][CH2:12][CH2:14][CH2:16][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:26][CH2:27][CH2:29][CH2:31][CH2:33][CH2:35][C:42](=[O:45])[O:49][CH2:39][C@H:41]([CH2:40][O:51][P:53](=[O:47])([O-:48])[O:50][CH2:38][CH2:37][N+:44]([CH3:3])([CH3:4])[CH3:5])[O:52][C:43]([CH2:36][CH2:34][CH2:32][CH2:30][CH2:28][CH2:25][CH2:17]/[CH:15]=[CH:13]\[CH2:11][CH2:9][CH2:7][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:000013027
slm:000013027
JLMJHJHQZIEXTR-XTSQRIEGSA-N
1-heneicosanoyl-2-(9Z-tetradecenoyl)-sn-glycero-3-phosphocholine
PC(21:0/14:1(9Z))
Phosphatidylcholine (21:0/14:1(9Z))

lipidmaps:LMGP01011955
lipidmapsM:LMGP01011955
JLMJHJHQZIEXTR-XTSQRIEGSA-N
PC(21:0/14:1(9Z))
1-heneicosanoyl-2-(9Z-tetradecenoyl)-glycero-3-phosphocholine
PC 35:1
PC(14:1_21:0)
PC(35:1)