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1-O-(11-methyldodecyl)-2-(9Z,12Z,15Z,18Z,21Z-tetracosapentaenoyl)-sn-glycero-3-phospho-N-(9Z,12Z,15Z-octadecatrienoyl)-ethanolamine

PropertiesImage
MNX_IDMNXM1026076 Image of MNXM1026076
referenceslm:000718465
formulaC60H103NO8P
global charge-1
mol weight997.457
InChIKeyMQPZFRDGQBXKFS-WPKSRIQKSA-M
InChIInChI=1S/C60H104NO8P/c1-5-7-9-11-13-15-17-19-21-22-23-24-25-26-28-30-32-34-39-43-47-51-60(63)69-58(55-66-53-48-44-40-36-35-37-41-45-49-57(3)4)56-68-70(64,65)67-54-52-61-59(62)50-46-42-38-33-31-29-27-20-18-16-14-12-10-8-6-2/h7-10,13-16,19-21,23-24,26-28,57-58H,5-6,11-12,17-18,22,25,29-56H2,1-4H3,(H,61,62)(H,64,65)/p-1/b9-7-,10-8-,15-13-,16-14-,21-19-,24-23-,27-20-,28-26-/t58-/m1/s1
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCC(=O)O[C@H](COCCCCCCCCCCC(C)C)COP(=O)([O-])OCCNC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC
MNX internals
InChI (mnx)InChI=1/C60H104NO8P/c1-5-7-9-11-13-15-17-19-21-22-23-24-25-26-28-30-32-34-39-43-47-51-60(63)69-58(55-66-53-48-44-40-36-35-37-41-45-49-57(3)4)56-68-70(64,65)67-54-52-61-59(62)50-46-42-38-33-31-29-27-20-18-16-14-12-10-8-6-2/h7-10,13-16,19-21,23-24,26-28,57-58H,5-6,11-12,17-18,22,25,29-56H2,1-4H3,(H,61,62)(H,64,65)/b9-7-,10-8-,15-13-,16-14-,21-19-,24-23-,27-20-,28-26-/t58-/m1/s1 Image of MNXM1026076
SMILES (mnx)[CH3:1][CH2:5]/[CH:7]=[CH:9]\[CH2:11]/[CH:13]=[CH:15]\[CH2:17]/[CH:19]=[CH:21]\[CH2:22]/[CH:23]=[CH:24]\[CH2:25]/[CH:26]=[CH:28]\[CH2:30][CH2:32][CH2:34][CH2:39][CH2:43][CH2:47][CH2:51][C:60](=[O:63])[O:69][C@H:58]([CH2:55][O:66][CH2:53][CH2:48][CH2:44][CH2:40][CH2:36][CH2:35][CH2:37][CH2:41][CH2:45][CH2:49][CH:57]([CH3:3])[CH3:4])[CH2:56][O:68][P:70]([OH:64])(=[O:65])[O:67][CH2:54][CH2:52][N:61]=[C:59]([CH2:50][CH2:46][CH2:42][CH2:38][CH2:33][CH2:31][CH2:29]/[CH:27]=[CH:20]\[CH2:18]/[CH:16]=[CH:14]\[CH2:12]/[CH:10]=[CH:8]\[CH2:6][CH3:2])[OH:62]
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:000718465
slm:000718465
MQPZFRDGQBXKFS-WPKSRIQKSA-M
1-O-(11-methyldodecyl)-2-(9Z,12Z,15Z,18Z,21Z-tetracosapentaenoyl)-sn-glycero-3-phospho-N-(9Z,12Z,15Z-octadecatrienoyl)-ethanolamine
N-(9Z,12Z,15Z-octadecatrienoyl)-1-O-(11-methyldodecyl)-2-(9Z,12Z,15Z,18Z,21Z-tetracosapentaenoyl)-sn-glycero-3-phosphoethanolamine
NAPE (O-13:0(11-me)/24:5(9Z,12Z,15Z,18Z,21Z)/18:3(9Z,12Z,15Z))