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1-acetyl-2-(13Z,16Z,19Z,22Z,25Z-octacosapentaenoyl)-sn-glycero-3-phosphocholine

PropertiesImage
MNX_IDMNXM342316 Image of MNXM342316
referenceslm:000012511
formulaC38H66NO8P
global charge0
mol weight695.919
InChIKeyYFVIBOXOEAVPNQ-YUQUIRSJSA-N
InChIInChI=1S/C38H66NO8P/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-38(41)47-37(34-44-36(2)40)35-46-48(42,43)45-33-32-39(3,4)5/h7-8,10-11,13-14,16-17,19-20,37H,6,9,12,15,18,21-35H2,1-5H3/b8-7-,11-10-,14-13-,17-16-,20-19-/t37-/m1/s1
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCC(=O)O[C@H](COC(C)=O)COP(=O)([O-])OCC[N+](C)(C)C
MNX internals
InChI (mnx)InChI=1/C38H66NO8P/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-38(41)47-37(34-44-36(2)40)35-46-48(42,43)45-33-32-39(3,4)5/h7-8,10-11,13-14,16-17,19-20,37H,6,9,12,15,18,21-35H2,1-5H3/b8-7-,11-10-,14-13-,17-16-,20-19-/t37-/m1/s1 Image of MNXM342316
SMILES (mnx)[CH3:1][CH2:6]/[CH:7]=[CH:8]\[CH2:9]/[CH:10]=[CH:11]\[CH2:12]/[CH:13]=[CH:14]\[CH2:15]/[CH:16]=[CH:17]\[CH2:18]/[CH:19]=[CH:20]\[CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][C:38](=[O:41])[O:47][C@H:37]([CH2:34][O:44][C:36]([CH3:2])=[O:40])[CH2:35][O:46][P:48](=[O:42])([O-:43])[O:45][CH2:33][CH2:32][N+:39]([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:000012511
slm:000012511
YFVIBOXOEAVPNQ-YUQUIRSJSA-N
1-acetyl-2-(13Z,16Z,19Z,22Z,25Z-octacosapentaenoyl)-sn-glycero-3-phosphocholine
PC(2:0/28:5(13Z,16Z,19Z,22Z,25Z))
Phosphatidylcholine (2:0/28:5(13Z,16Z,19Z,22Z,25Z))