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1-O-eicosyl-2-heptadecanoyl-sn-glycero-3-phosphocholine

PropertiesImage
MNX_IDMNXM70934 Image of MNXM70934
referenceslm:000028012
formulaC45H92NO7P
global charge0
mol weight790.205
InChIKeyOGZFLEXUILHMQP-USYZEHPZSA-N
InChIInChI=1S/C45H92NO7P/c1-6-8-10-12-14-16-18-20-22-23-24-25-27-29-31-33-35-37-40-50-42-44(43-52-54(48,49)51-41-39-46(3,4)5)53-45(47)38-36-34-32-30-28-26-21-19-17-15-13-11-9-7-2/h44H,6-43H2,1-5H3/t44-/m1/s1
SMILESCCCCCCCCCCCCCCCCCCCCOC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C45H92NO7P/c1-6-8-10-12-14-16-18-20-22-23-24-25-27-29-31-33-35-37-40-50-42-44(43-52-54(48,49)51-41-39-46(3,4)5)53-45(47)38-36-34-32-30-28-26-21-19-17-15-13-11-9-7-2/h44H,6-43H2,1-5H3/t44-/m1/s1 Image of MNXM70934
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][CH2:27][CH2:29][CH2:31][CH2:33][CH2:35][CH2:37][CH2:40][O:50][CH2:42][C@H:44]([CH2:43][O:52][P:54](=[O:48])([O-:49])[O:51][CH2:41][CH2:39][N+:46]([CH3:3])([CH3:4])[CH3:5])[O:53][C:45]([CH2:38][CH2:36][CH2:34][CH2:32][CH2:30][CH2:28][CH2:26][CH2:21][CH2:19][CH2:17][CH2:15][CH2:13][CH2:11][CH2:9][CH2:7][CH3:2])=[O:47]
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:000028012
slm:000028012
OGZFLEXUILHMQP-USYZEHPZSA-N 		1-O-eicosyl-2-heptadecanoyl-sn-glycero-3-phosphocholine
1-eicosyl-2-heptadecanoyl-sn-glycero-3-phosphocholine
PC(O-20:0/17:0)
Phosphatidylcholine (O-20:0/17:0)

lipidmaps:LMGP01020223
lipidmapsM:LMGP01020223
OGZFLEXUILHMQP-USYZEHPZSA-N 		PC(O-20:0/17:0)
1-eicosyl-2-heptadecanoyl-glycero-3-phosphocholine
PC O-37:0
PC(O-20:0/17:0)
PC(O-37:0)