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1-(14Z,17Z,20Z,23Z,26Z,29Z-dotriacontahexaenoyl)-2-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-sn-glycero-3-phosphocholine

PropertiesImage
MNX_IDMNXM225563 Image of MNXM225563
referenceslm:000009219
formulaC60H100NO8P
global charge0
mol weight994.433
InChIKeyRQUUDFJMHREJES-GBTFXTIDSA-N
InChIInChI=1S/C60H100NO8P/c1-6-8-10-12-14-16-18-20-22-24-25-26-27-28-29-30-31-32-33-34-35-37-38-40-42-44-46-48-50-52-59(62)66-56-58(57-68-70(64,65)67-55-54-61(3,4)5)69-60(63)53-51-49-47-45-43-41-39-36-23-21-19-17-15-13-11-9-7-2/h8,10,14-17,20-23,25-26,28-29,31-32,39,41,45,47,58H,6-7,9,11-13,18-19,24,27,30,33-38,40,42-44,46,48-57H2,1-5H3/b10-8-,16-14-,17-15-,22-20-,23-21-,26-25-,29-28-,32-31-,41-39-,47-45-/t58-/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)CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC
MNX internals
InChI (mnx)InChI=1/C60H100NO8P/c1-6-8-10-12-14-16-18-20-22-24-25-26-27-28-29-30-31-32-33-34-35-37-38-40-42-44-46-48-50-52-59(62)66-56-58(57-68-70(64,65)67-55-54-61(3,4)5)69-60(63)53-51-49-47-45-43-41-39-36-23-21-19-17-15-13-11-9-7-2/h8,10,14-17,20-23,25-26,28-29,31-32,39,41,45,47,58H,6-7,9,11-13,18-19,24,27,30,33-38,40,42-44,46,48-57H2,1-5H3/b10-8-,16-14-,17-15-,22-20-,23-21-,26-25-,29-28-,32-31-,41-39-,47-45-/t58-/m1/s1 Image of MNXM225563
SMILES (mnx)[CH3:1][CH2:6]/[CH:8]=[CH:10]\[CH2:12]/[CH:14]=[CH:16]\[CH2:18]/[CH:20]=[CH:22]\[CH2:24]/[CH:25]=[CH:26]\[CH2:27]/[CH:28]=[CH:29]\[CH2:30]/[CH:31]=[CH:32]\[CH2:33][CH2:34][CH2:35][CH2:37][CH2:38][CH2:40][CH2:42][CH2:44][CH2:46][CH2:48][CH2:50][CH2:52][C:59](=[O:62])[O:66][CH2:56][C@H:58]([CH2:57][O:68][P:70](=[O:64])([O-:65])[O:67][CH2:55][CH2:54][N+:61]([CH3:3])([CH3:4])[CH3:5])[O:69][C:60]([CH2:53][CH2:51][CH2:49]/[CH:47]=[CH:45]\[CH2:43]/[CH:41]=[CH:39]\[CH2:36]/[CH:23]=[CH:21]\[CH2:19]/[CH:17]=[CH:15]\[CH2:13][CH2:11][CH2:9][CH2:7][CH3:2])=[O:63]
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:000009219
slm:000009219
RQUUDFJMHREJES-GBTFXTIDSA-N
1-(14Z,17Z,20Z,23Z,26Z,29Z-dotriacontahexaenoyl)-2-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-sn-glycero-3-phosphocholine
PC(32:6(14Z,17Z,20Z,23Z,26Z,29Z)/20:4(5Z,8Z,11Z,14Z))
Phosphatidylcholine (32:6(14Z,17Z,20Z,23Z,26Z,29Z)/20:4(5Z,8Z,11Z,14Z))