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1,2-di-(11-methyldodecanoyl)-sn-glycero-3-phosphocholine

PropertiesImage
MNX_IDMNXM174490 Image of MNXM174490
referenceslm:000012423
formulaC34H68NO8P
global charge0
mol weight649.891
InChIKeyRFRXJNWSGHQEOL-JGCGQSQUSA-N
InChIInChI=1S/C34H68NO8P/c1-30(2)22-18-14-10-8-12-16-20-24-33(36)40-28-32(29-42-44(38,39)41-27-26-35(5,6)7)43-34(37)25-21-17-13-9-11-15-19-23-31(3)4/h30-32H,8-29H2,1-7H3/t32-/m1/s1
SMILESCC(C)CCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCC(C)C
MNX internals
InChI (mnx)InChI=1/C34H68NO8P/c1-30(2)22-18-14-10-8-12-16-20-24-33(36)40-28-32(29-42-44(38,39)41-27-26-35(5,6)7)43-34(37)25-21-17-13-9-11-15-19-23-31(3)4/h30-32H,8-29H2,1-7H3/t32-/m1/s1 Image of MNXM174490
SMILES (mnx)[CH3:1][CH:30]([CH3:2])[CH2:22][CH2:18][CH2:14][CH2:10][CH2:8][CH2:12][CH2:16][CH2:20][CH2:24][C:33](=[O:36])[O:40][CH2:28][C@H:32]([CH2:29][O:42][P:44](=[O:38])([O-:39])[O:41][CH2:27][CH2:26][N+:35]([CH3:5])([CH3:6])[CH3:7])[O:43][C:34]([CH2:25][CH2:21][CH2:17][CH2:13][CH2:9][CH2:11][CH2:15][CH2:19][CH2:23][CH:31]([CH3:3])[CH3:4])=[O:37]
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:000012423
slm:000012423
RFRXJNWSGHQEOL-JGCGQSQUSA-N
1,2-di-(11-methyldodecanoyl)-sn-glycero-3-phosphocholine
PC(13:0/13:0)
Phosphatidylcholine (13:0/13:0)