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1-(11E-octadecenoyl)-2-triacontanoyl-sn-glycero-3-phosphocholine

PropertiesImage
MNX_IDMNXM193051 Image of MNXM193051
referenceslm:000008075
formulaC56H110NO8P
global charge0
mol weight956.469
InChIKeyOJYKSHWXWVBDKN-JFWHZKMCSA-N
InChIInChI=1S/C56H110NO8P/c1-6-8-10-12-14-16-18-20-22-23-24-25-26-27-28-29-30-31-32-33-35-37-39-41-43-45-47-49-56(59)65-54(53-64-66(60,61)63-51-50-57(3,4)5)52-62-55(58)48-46-44-42-40-38-36-34-21-19-17-15-13-11-9-7-2/h17,19,54H,6-16,18,20-53H2,1-5H3/b19-17+/t54-/m1/s1
SMILESCCCCCC/C=C/CCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C56H110NO8P/c1-6-8-10-12-14-16-18-20-22-23-24-25-26-27-28-29-30-31-32-33-35-37-39-41-43-45-47-49-56(59)65-54(53-64-66(60,61)63-51-50-57(3,4)5)52-62-55(58)48-46-44-42-40-38-36-34-21-19-17-15-13-11-9-7-2/h17,19,54H,6-16,18,20-53H2,1-5H3/b19-17+/t54-/m1/s1 Image of MNXM193051
SMILES (mnx)[CH3:1][CH2:6][CH2:8][CH2:10][CH2:12][CH2:14][CH2:16][CH2:18][CH2:20][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:35][CH2:37][CH2:39][CH2:41][CH2:43][CH2:45][CH2:47][CH2:49][C:56](=[O:59])[O:65][C@H:54]([CH2:52][O:62][C:55]([CH2:48][CH2:46][CH2:44][CH2:42][CH2:40][CH2:38][CH2:36][CH2:34][CH2:21]/[CH:19]=[CH:17]/[CH2:15][CH2:13][CH2:11][CH2:9][CH2:7][CH3:2])=[O:58])[CH2:53][O:64][P:66](=[O:60])([O-:61])[O:63][CH2:51][CH2:50][N+:57]([CH3:3])([CH3:4])[CH3:5]
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:000008075
slm:000008075
OJYKSHWXWVBDKN-JFWHZKMCSA-N
1-(11E-octadecenoyl)-2-triacontanoyl-sn-glycero-3-phosphocholine
PC(18:1(11E)/30:0)
Phosphatidylcholine (18:1(11E)/30:0)