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1-(15Z,18Z,21Z,24Z-triacontatetraenoyl)-2-(11Z-eicosenoyl)-sn-glycero-3-phospho-N-dodecanoyl-ethanolamine

PropertiesImage
MNX_IDMNXM965532 Image of MNXM965532
referenceslm:000657917
formulaC67H121NO9P
global charge-1
mol weight1115.677
InChIKeyFKXMJODWPDROON-MJCSKXLLSA-M
InChIInChI=1S/C67H122NO9P/c1-4-7-10-13-16-19-21-23-25-27-28-29-30-31-32-33-34-35-36-38-39-41-43-46-49-52-55-58-66(70)74-62-64(63-76-78(72,73)75-61-60-68-65(69)57-54-51-48-45-18-15-12-9-6-3)77-67(71)59-56-53-50-47-44-42-40-37-26-24-22-20-17-14-11-8-5-2/h16,19,23-26,28-29,31-32,64H,4-15,17-18,20-22,27,30,33-63H2,1-3H3,(H,68,69)(H,72,73)/p-1/b19-16-,25-23-,26-24-,29-28-,32-31-/t64-/m1/s1
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCCNC(=O)CCCCCCCCCCC)OC(=O)CCCCCCCCC/C=C\CCCCCCCC
MNX internals
InChI (mnx)InChI=1/C67H122NO9P/c1-4-7-10-13-16-19-21-23-25-27-28-29-30-31-32-33-34-35-36-38-39-41-43-46-49-52-55-58-66(70)74-62-64(63-76-78(72,73)75-61-60-68-65(69)57-54-51-48-45-18-15-12-9-6-3)77-67(71)59-56-53-50-47-44-42-40-37-26-24-22-20-17-14-11-8-5-2/h16,19,23-26,28-29,31-32,64H,4-15,17-18,20-22,27,30,33-63H2,1-3H3,(H,68,69)(H,72,73)/b19-16-,25-23-,26-24-,29-28-,32-31-/t64-/m1/s1 Image of MNXM965532
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:19]\[CH2:21]/[CH:23]=[CH:25]\[CH2:27]/[CH:28]=[CH:29]\[CH2:30]/[CH:31]=[CH:32]\[CH2:33][CH2:34][CH2:35][CH2:36][CH2:38][CH2:39][CH2:41][CH2:43][CH2:46][CH2:49][CH2:52][CH2:55][CH2:58][C:66](=[O:70])[O:74][CH2:62][C@H:64]([CH2:63][O:76][P:78]([OH:72])(=[O:73])[O:75][CH2:61][CH2:60][N:68]=[C:65]([CH2:57][CH2:54][CH2:51][CH2:48][CH2:45][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])[OH:69])[O:77][C:67]([CH2:59][CH2:56][CH2:53][CH2:50][CH2:47][CH2:44][CH2:42][CH2:40][CH2:37]/[CH:26]=[CH:24]\[CH2:22][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:71]
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:000657917
slm:000657917
FKXMJODWPDROON-MJCSKXLLSA-M
1-(15Z,18Z,21Z,24Z-triacontatetraenoyl)-2-(11Z-eicosenoyl)-sn-glycero-3-phospho-N-dodecanoyl-ethanolamine
N-dodecanoyl-1-(15Z,18Z,21Z,24Z-triacontatetraenoyl)-2-(11Z-eicosenoyl)-sn-glycero-3-phosphoethanolamine
NAPE (30:4(15Z,18Z,21Z,24Z)/20:1(11Z)/12:0)