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1-O-(1Z,13-methyltetradecenyl)-sn-glycero-3-phospho-N-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-ethanolamine

PropertiesImage
MNX_IDMNXM1048136 Image of MNXM1048136
referenceslm:000740525
formulaC42H71NO7P
global charge-1
mol weight733.004
InChIKeyFVMRMDMVVSDXHQ-KXSVMPPHSA-M
InChIInChI=1S/C42H72NO7P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-25-28-31-34-42(45)43-35-37-49-51(46,47)50-39-41(44)38-48-36-32-29-26-23-20-19-21-24-27-30-33-40(2)3/h5-6,8-9,11-12,14-15,17-18,25,28,32,36,40-41,44H,4,7,10,13,16,19-24,26-27,29-31,33-35,37-39H2,1-3H3,(H,43,45)(H,46,47)/p-1/b6-5-,9-8-,12-11-,15-14-,18-17-,28-25-,36-32-/t41-/m1/s1
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)NCCOP(=O)([O-])OC[C@H](O)CO/C=C\CCCCCCCCCCC(C)C
MNX internals
InChI (mnx)InChI=1/C42H72NO7P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-25-28-31-34-42(45)43-35-37-49-51(46,47)50-39-41(44)38-48-36-32-29-26-23-20-19-21-24-27-30-33-40(2)3/h5-6,8-9,11-12,14-15,17-18,25,28,32,36,40-41,44H,4,7,10,13,16,19-24,26-27,29-31,33-35,37-39H2,1-3H3,(H,43,45)(H,46,47)/b6-5-,9-8-,12-11-,15-14-,18-17-,28-25-,36-32-/t41-/m1/s1 Image of MNXM1048136
SMILES (mnx)[CH3:1][CH2:4]/[CH:5]=[CH:6]\[CH2:7]/[CH:8]=[CH:9]\[CH2:10]/[CH:11]=[CH:12]\[CH2:13]/[CH:14]=[CH:15]\[CH2:16]/[CH:17]=[CH:18]\[CH2:22]/[CH:25]=[CH:28]\[CH2:31][CH2:34][C:42](=[N:43][CH2:35][CH2:37][O:49][P:51]([OH:46])(=[O:47])[O:50][CH2:39][C@@H:41]([CH2:38][O:48]/[CH:36]=[CH:32]\[CH2:29][CH2:26][CH2:23][CH2:20][CH2:19][CH2:21][CH2:24][CH2:27][CH2:30][CH2:33][CH:40]([CH3:2])[CH3:3])[OH:44])[OH:45]
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:000740525
slm:000740525
FVMRMDMVVSDXHQ-KXSVMPPHSA-M
1-O-(1Z,13-methyltetradecenyl)-sn-glycero-3-phospho-N-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-ethanolamine
N-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-1-O-(1Z,13-methyltetradecenyl)-sn-glycero-3-phosphoethanolamine
NAPE (P-15:0(13-me)/0:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))