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1-O-(1Z-triacontenyl)-2-(13Z,16Z,19Z,22Z-octacosatetraenoyl)-sn-glycero-3-phospho-N-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-ethanolamine

PropertiesImage
MNX_IDMNXM1018226 Image of MNXM1018226
referenceslm:000710615
formulaC83H147NO8P
global charge-1
mol weight1318.062
InChIKeyFZHRJJPHNXLBKL-LBNBNVNTSA-M
InChIInChI=1S/C83H148NO8P/c1-4-7-10-13-16-19-22-25-28-31-33-35-37-39-40-41-43-45-47-49-52-55-58-61-64-67-70-73-77-89-79-81(80-91-93(87,88)90-78-76-84-82(85)74-71-68-65-62-59-56-53-50-30-27-24-21-18-15-12-9-6-3)92-83(86)75-72-69-66-63-60-57-54-51-48-46-44-42-38-36-34-32-29-26-23-20-17-14-11-8-5-2/h17-18,20-21,26-27,29-30,34,36,42,44,53,56,62,65,73,77,81H,4-16,19,22-25,28,31-33,35,37-41,43,45-52,54-55,57-61,63-64,66-72,74-76,78-80H2,1-3H3,(H,84,85)(H,87,88)/p-1/b20-17-,21-18-,29-26-,30-27-,36-34-,44-42-,56-53-,65-62-,77-73-/t81-/m1/s1
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCC(=O)O[C@H](CO/C=C\CCCCCCCCCCCCCCCCCCCCCCCCCCCC)COP(=O)([O-])OCCNC(=O)CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC
MNX internals
InChI (mnx)InChI=1/C83H148NO8P/c1-4-7-10-13-16-19-22-25-28-31-33-35-37-39-40-41-43-45-47-49-52-55-58-61-64-67-70-73-77-89-79-81(80-91-93(87,88)90-78-76-84-82(85)74-71-68-65-62-59-56-53-50-30-27-24-21-18-15-12-9-6-3)92-83(86)75-72-69-66-63-60-57-54-51-48-46-44-42-38-36-34-32-29-26-23-20-17-14-11-8-5-2/h17-18,20-21,26-27,29-30,34,36,42,44,53,56,62,65,73,77,81H,4-16,19,22-25,28,31-33,35,37-41,43,45-52,54-55,57-61,63-64,66-72,74-76,78-80H2,1-3H3,(H,84,85)(H,87,88)/b20-17-,21-18-,29-26-,30-27-,36-34-,44-42-,56-53-,65-62-,77-73-/t81-/m1/s1 Image of MNXM1018226
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22][CH2:25][CH2:28][CH2:31][CH2:33][CH2:35][CH2:37][CH2:39][CH2:40][CH2:41][CH2:43][CH2:45][CH2:47][CH2:49][CH2:52][CH2:55][CH2:58][CH2:61][CH2:64][CH2:67][CH2:70]/[CH:73]=[CH:77]\[O:89][CH2:79][C@H:81]([CH2:80][O:91][P:93]([OH:87])(=[O:88])[O:90][CH2:78][CH2:76][N:84]=[C:82]([CH2:74][CH2:71][CH2:68]/[CH:65]=[CH:62]\[CH2:59]/[CH:56]=[CH:53]\[CH2:50]/[CH:30]=[CH:27]\[CH2:24]/[CH:21]=[CH:18]\[CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])[OH:85])[O:92][C:83]([CH2:75][CH2:72][CH2:69][CH2:66][CH2:63][CH2:60][CH2:57][CH2:54][CH2:51][CH2:48][CH2:46]/[CH:44]=[CH:42]\[CH2:38]/[CH:36]=[CH:34]\[CH2:32]/[CH:29]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:86]
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:000710615
slm:000710615
FZHRJJPHNXLBKL-LBNBNVNTSA-M
1-O-(1Z-triacontenyl)-2-(13Z,16Z,19Z,22Z-octacosatetraenoyl)-sn-glycero-3-phospho-N-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-ethanolamine
N-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-1-O-(1Z-triacontenyl)-2-(13Z,16Z,19Z,22Z-octacosatetraenoyl)-sn-glycero-3-phosphoethanolamine
NAPE (P-30:0/28:4(13Z,16Z,19Z,22Z)/20:4(5Z,8Z,11Z,14Z))