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1-(7Z,10Z,13Z,16Z-docosatetraenoyl)-2-(15Z,18Z,21Z,24Z,27Z-triacontapentaenoyl)-sn-glycero-3-phospho-N-hexadecanoyl-ethanolamine

PropertiesImage
MNX_IDMNXM960270 Image of MNXM960270
referenceslm:000652655
formulaC73H125NO9P
global charge-1
mol weight1191.775
InChIKeyWZNVIKWXQTUTKA-NRSBJKKTSA-M
InChIInChI=1S/C73H126NO9P/c1-4-7-10-13-16-19-22-25-27-29-31-32-33-34-35-36-37-38-40-42-44-47-50-53-56-59-62-65-73(77)83-70(68-80-72(76)64-61-58-55-52-49-46-43-41-39-30-28-26-23-20-17-14-11-8-5-2)69-82-84(78,79)81-67-66-74-71(75)63-60-57-54-51-48-45-24-21-18-15-12-9-6-3/h7,10,16-17,19-20,25-28,31-32,34-35,39,41,46,49,70H,4-6,8-9,11-15,18,21-24,29-30,33,36-38,40,42-45,47-48,50-69H2,1-3H3,(H,74,75)(H,78,79)/p-1/b10-7-,19-16-,20-17-,27-25-,28-26-,32-31-,35-34-,41-39-,49-46-/t70-/m1/s1
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)COP(=O)([O-])OCCNC(=O)CCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C73H126NO9P/c1-4-7-10-13-16-19-22-25-27-29-31-32-33-34-35-36-37-38-40-42-44-47-50-53-56-59-62-65-73(77)83-70(68-80-72(76)64-61-58-55-52-49-46-43-41-39-30-28-26-23-20-17-14-11-8-5-2)69-82-84(78,79)81-67-66-74-71(75)63-60-57-54-51-48-45-24-21-18-15-12-9-6-3/h7,10,16-17,19-20,25-28,31-32,34-35,39,41,46,49,70H,4-6,8-9,11-15,18,21-24,29-30,33,36-38,40,42-45,47-48,50-69H2,1-3H3,(H,74,75)(H,78,79)/b10-7-,19-16-,20-17-,27-25-,28-26-,32-31-,35-34-,41-39-,49-46-/t70-/m1/s1 Image of MNXM960270
SMILES (mnx)[CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:27]\[CH2:29]/[CH:31]=[CH:32]\[CH2:33]/[CH:34]=[CH:35]\[CH2:36][CH2:37][CH2:38][CH2:40][CH2:42][CH2:44][CH2:47][CH2:50][CH2:53][CH2:56][CH2:59][CH2:62][CH2:65][C:73](=[O:77])[O:83][C@H:70]([CH2:68][O:80][C:72]([CH2:64][CH2:61][CH2:58][CH2:55][CH2:52]/[CH:49]=[CH:46]\[CH2:43]/[CH:41]=[CH:39]\[CH2:30]/[CH:28]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:76])[CH2:69][O:82][P:84]([OH:78])(=[O:79])[O:81][CH2:67][CH2:66][N:74]=[C:71]([CH2:63][CH2:60][CH2:57][CH2:54][CH2:51][CH2:48][CH2:45][CH2:24][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])[OH:75]
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:000652655
slm:000652655
WZNVIKWXQTUTKA-NRSBJKKTSA-M
1-(7Z,10Z,13Z,16Z-docosatetraenoyl)-2-(15Z,18Z,21Z,24Z,27Z-triacontapentaenoyl)-sn-glycero-3-phospho-N-hexadecanoyl-ethanolamine
N-hexadecanoyl-1-(7Z,10Z,13Z,16Z-docosatetraenoyl)-2-(15Z,18Z,21Z,24Z,27Z-triacontapentaenoyl)-sn-glycero-3-phosphoethanolamine
NAPE (22:4(7Z,10Z,13Z,16Z)/30:5(15Z,18Z,21Z,24Z,27Z)/16:0)