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1-O-octacosyl-2-(19Z,22Z,25Z,28Z-tetratriacontatetraenoyl)-sn-glycero-3-phospho-N-dodecanoyl-ethanolamine

PropertiesImage
MNX_IDMNXM1038252 Image of MNXM1038252
referenceslm:000730641
formulaC79H149NO8P
global charge-1
mol weight1272.034
InChIKeyHWYPJNVQDHWRCR-VZLMTUSZSA-M
InChIInChI=1S/C79H150NO8P/c1-4-7-10-13-16-19-21-23-25-27-29-31-33-35-37-38-39-40-41-42-44-46-48-50-52-54-56-59-62-65-68-71-79(82)88-77(76-87-89(83,84)86-74-72-80-78(81)70-67-64-61-58-18-15-12-9-6-3)75-85-73-69-66-63-60-57-55-53-51-49-47-45-43-36-34-32-30-28-26-24-22-20-17-14-11-8-5-2/h16,19,23,25,29,31,35,37,77H,4-15,17-18,20-22,24,26-28,30,32-34,36,38-76H2,1-3H3,(H,80,81)(H,83,84)/p-1/b19-16-,25-23-,31-29-,37-35-/t77-/m1/s1
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCCCC(=O)O[C@H](COCCCCCCCCCCCCCCCCCCCCCCCCCCCC)COP(=O)([O-])OCCNC(=O)CCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C79H150NO8P/c1-4-7-10-13-16-19-21-23-25-27-29-31-33-35-37-38-39-40-41-42-44-46-48-50-52-54-56-59-62-65-68-71-79(82)88-77(76-87-89(83,84)86-74-72-80-78(81)70-67-64-61-58-18-15-12-9-6-3)75-85-73-69-66-63-60-57-55-53-51-49-47-45-43-36-34-32-30-28-26-24-22-20-17-14-11-8-5-2/h16,19,23,25,29,31,35,37,77H,4-15,17-18,20-22,24,26-28,30,32-34,36,38-76H2,1-3H3,(H,80,81)(H,83,84)/b19-16-,25-23-,31-29-,37-35-/t77-/m1/s1 Image of MNXM1038252
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:29]=[CH:31]\[CH2:33]/[CH:35]=[CH:37]\[CH2:38][CH2:39][CH2:40][CH2:41][CH2:42][CH2:44][CH2:46][CH2:48][CH2:50][CH2:52][CH2:54][CH2:56][CH2:59][CH2:62][CH2:65][CH2:68][CH2:71][C:79](=[O:82])[O:88][C@H:77]([CH2:75][O:85][CH2:73][CH2:69][CH2:66][CH2:63][CH2:60][CH2:57][CH2:55][CH2:53][CH2:51][CH2:49][CH2:47][CH2:45][CH2:43][CH2:36][CH2:34][CH2:32][CH2:30][CH2:28][CH2:26][CH2:24][CH2:22][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])[CH2:76][O:87][P:89]([OH:83])(=[O:84])[O:86][CH2:74][CH2:72][N:80]=[C:78]([CH2:70][CH2:67][CH2:64][CH2:61][CH2:58][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])[OH:81]
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:000730641
slm:000730641
HWYPJNVQDHWRCR-VZLMTUSZSA-M
1-O-octacosyl-2-(19Z,22Z,25Z,28Z-tetratriacontatetraenoyl)-sn-glycero-3-phospho-N-dodecanoyl-ethanolamine
N-dodecanoyl-1-O-octacosyl-2-(19Z,22Z,25Z,28Z-tetratriacontatetraenoyl)-sn-glycero-3-phosphoethanolamine
NAPE (O-28:0/34:4(19Z,22Z,25Z,28Z)/12:0)