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1-(13-methyltetradecanoyl)-2-(15Z-tetracosenoyl)-sn-glycero-3-phosphocholine

PropertiesImage
MNX_IDMNXM212907 Image of MNXM212907
referenceslm:000008809
formulaC47H92NO8P
global charge0
mol weight830.226
InChIKeyAJUCLAQIHVCWRO-DCPGAEAUSA-N
InChIInChI=1S/C47H92NO8P/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-26-30-33-36-39-47(50)56-45(43-55-57(51,52)54-41-40-48(4,5)6)42-53-46(49)38-35-32-29-27-24-25-28-31-34-37-44(2)3/h14-15,44-45H,7-13,16-43H2,1-6H3/b15-14-/t45-/m1/s1
SMILESCCCCCCCC/C=C\CCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCC(C)C)COP(=O)([O-])OCC[N+](C)(C)C
MNX internals
InChI (mnx)InChI=1/C47H92NO8P/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-26-30-33-36-39-47(50)56-45(43-55-57(51,52)54-41-40-48(4,5)6)42-53-46(49)38-35-32-29-27-24-25-28-31-34-37-44(2)3/h14-15,44-45H,7-13,16-43H2,1-6H3/b15-14-/t45-/m1/s1 Image of MNXM212907
SMILES (mnx)[CH3:1][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13]/[CH:14]=[CH:15]\[CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:26][CH2:30][CH2:33][CH2:36][CH2:39][C:47](=[O:50])[O:56][C@H:45]([CH2:42][O:53][C:46]([CH2:38][CH2:35][CH2:32][CH2:29][CH2:27][CH2:24][CH2:25][CH2:28][CH2:31][CH2:34][CH2:37][CH:44]([CH3:2])[CH3:3])=[O:49])[CH2:43][O:55][P:57](=[O:51])([O-:52])[O:54][CH2:41][CH2:40][N+:48]([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:000008809
slm:000008809
AJUCLAQIHVCWRO-DCPGAEAUSA-N
1-(13-methyltetradecanoyl)-2-(15Z-tetracosenoyl)-sn-glycero-3-phosphocholine
PC(15:0/24:1(15Z))
Phosphatidylcholine (15:0/24:1(15Z))