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1-(14Z,17Z,20Z,23Z,26Z,29Z-dotriacontahexaenoyl)-2-(6Z-octadecenoyl)-sn-glycero-3-phosphocholine

PropertiesImage
MNX_IDMNXM225647 Image of MNXM225647
referenceslm:000009225
formulaC58H102NO8P
global charge0
mol weight972.427
InChIKeyAMVYTSRVQQVPNL-UODWOSETSA-N
InChIInChI=1S/C58H102NO8P/c1-6-8-10-12-14-16-18-20-22-23-24-25-26-27-28-29-30-31-32-33-34-35-37-38-40-42-44-46-48-50-57(60)64-54-56(55-66-68(62,63)65-53-52-59(3,4)5)67-58(61)51-49-47-45-43-41-39-36-21-19-17-15-13-11-9-7-2/h8,10,14,16,20,22,24-25,27-28,30-31,41,43,56H,6-7,9,11-13,15,17-19,21,23,26,29,32-40,42,44-55H2,1-5H3/b10-8-,16-14-,22-20-,25-24-,28-27-,31-30-,43-41-/t56-/m1/s1
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCC/C=C\CCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C58H102NO8P/c1-6-8-10-12-14-16-18-20-22-23-24-25-26-27-28-29-30-31-32-33-34-35-37-38-40-42-44-46-48-50-57(60)64-54-56(55-66-68(62,63)65-53-52-59(3,4)5)67-58(61)51-49-47-45-43-41-39-36-21-19-17-15-13-11-9-7-2/h8,10,14,16,20,22,24-25,27-28,30-31,41,43,56H,6-7,9,11-13,15,17-19,21,23,26,29,32-40,42,44-55H2,1-5H3/b10-8-,16-14-,22-20-,25-24-,28-27-,31-30-,43-41-/t56-/m1/s1 Image of MNXM225647
SMILES (mnx)[CH3:1][CH2:6]/[CH:8]=[CH:10]\[CH2:12]/[CH:14]=[CH:16]\[CH2:18]/[CH:20]=[CH:22]\[CH2:23]/[CH:24]=[CH:25]\[CH2:26]/[CH:27]=[CH:28]\[CH2:29]/[CH:30]=[CH:31]\[CH2:32][CH2:33][CH2:34][CH2:35][CH2:37][CH2:38][CH2:40][CH2:42][CH2:44][CH2:46][CH2:48][CH2:50][C:57](=[O:60])[O:64][CH2:54][C@H:56]([CH2:55][O:66][P:68](=[O:62])([O-:63])[O:65][CH2:53][CH2:52][N+:59]([CH3:3])([CH3:4])[CH3:5])[O:67][C:58]([CH2:51][CH2:49][CH2:47][CH2:45]/[CH:43]=[CH:41]\[CH2:39][CH2:36][CH2:21][CH2:19][CH2:17][CH2:15][CH2:13][CH2:11][CH2:9][CH2:7][CH3:2])=[O:61]
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:000009225
slm:000009225
AMVYTSRVQQVPNL-UODWOSETSA-N
1-(14Z,17Z,20Z,23Z,26Z,29Z-dotriacontahexaenoyl)-2-(6Z-octadecenoyl)-sn-glycero-3-phosphocholine
PC(32:6(14Z,17Z,20Z,23Z,26Z,29Z)/18:1(6Z))
Phosphatidylcholine (32:6(14Z,17Z,20Z,23Z,26Z,29Z)/18:1(6Z))