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1-O-hexadecyl-2-(8Z,11Z,14Z-eicosatrienoyl)-sn-glycero-3-phospho-N-(9Z-octadecenoyl)-ethanolamine

PropertiesImage
MNX_IDMNXM1029904 Image of MNXM1029904
referenceslm:000722293
formulaC59H109NO8P
global charge-1
mol weight991.494
InChIKeySZZDLPWQBNYAQB-AZDSCLNJSA-M
InChIInChI=1S/C59H110NO8P/c1-4-7-10-13-16-19-22-25-28-29-31-33-36-39-42-45-48-51-59(62)68-57(55-65-53-49-46-43-40-37-34-27-24-21-18-15-12-9-6-3)56-67-69(63,64)66-54-52-60-58(61)50-47-44-41-38-35-32-30-26-23-20-17-14-11-8-5-2/h16,19,25-26,28,30-31,33,57H,4-15,17-18,20-24,27,29,32,34-56H2,1-3H3,(H,60,61)(H,63,64)/p-1/b19-16-,28-25-,30-26-,33-31-/t57-/m1/s1
SMILESCCCCC/C=C\C/C=C\C/C=C\CCCCCCC(=O)O[C@H](COCCCCCCCCCCCCCCCC)COP(=O)([O-])OCCNC(=O)CCCCCCC/C=C\CCCCCCCC
MNX internals
InChI (mnx)InChI=1/C59H110NO8P/c1-4-7-10-13-16-19-22-25-28-29-31-33-36-39-42-45-48-51-59(62)68-57(55-65-53-49-46-43-40-37-34-27-24-21-18-15-12-9-6-3)56-67-69(63,64)66-54-52-60-58(61)50-47-44-41-38-35-32-30-26-23-20-17-14-11-8-5-2/h16,19,25-26,28,30-31,33,57H,4-15,17-18,20-24,27,29,32,34-56H2,1-3H3,(H,60,61)(H,63,64)/b19-16-,28-25-,30-26-,33-31-/t57-/m1/s1 Image of MNXM1029904
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:28]\[CH2:29]/[CH:31]=[CH:33]\[CH2:36][CH2:39][CH2:42][CH2:45][CH2:48][CH2:51][C:59](=[O:62])[O:68][C@H:57]([CH2:55][O:65][CH2:53][CH2:49][CH2:46][CH2:43][CH2:40][CH2:37][CH2:34][CH2:27][CH2:24][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])[CH2:56][O:67][P:69]([OH:63])(=[O:64])[O:66][CH2:54][CH2:52][N:60]=[C:58]([CH2:50][CH2:47][CH2:44][CH2:41][CH2:38][CH2:35][CH2:32]/[CH:30]=[CH:26]\[CH2:23][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])[OH: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:000722293
slm:000722293
SZZDLPWQBNYAQB-AZDSCLNJSA-M
1-O-hexadecyl-2-(8Z,11Z,14Z-eicosatrienoyl)-sn-glycero-3-phospho-N-(9Z-octadecenoyl)-ethanolamine
N-(9Z-octadecenoyl)-1-O-hexadecyl-2-(8Z,11Z,14Z-eicosatrienoyl)-sn-glycero-3-phosphoethanolamine
NAPE (O-16:0/20:3(8Z,11Z,14Z)/18:1(9Z))