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1-(21Z,24Z,27Z,30Z,33Z-hexatriacontapentaenoyl)-2-octadecanoyl-sn-glycero-3-phospho-N-octadecanoyl-ethanolamine

PropertiesImage
MNX_IDMNXM938879 Image of MNXM938879
referenceslm:000631264
formulaC77H141NO9P
global charge-1
mol weight1255.947
InChIKeyFKDCYBDCIHGWLW-HPZWFZFKSA-M
InChIInChI=1S/C77H142NO9P/c1-4-7-10-13-16-19-22-25-28-29-30-31-32-33-34-35-36-37-38-39-40-41-42-43-44-45-48-50-53-56-59-62-65-68-76(80)84-72-74(87-77(81)69-66-63-60-57-54-51-47-27-24-21-18-15-12-9-6-3)73-86-88(82,83)85-71-70-78-75(79)67-64-61-58-55-52-49-46-26-23-20-17-14-11-8-5-2/h7,10,16,19,25,28,30-31,33-34,74H,4-6,8-9,11-15,17-18,20-24,26-27,29,32,35-73H2,1-3H3,(H,78,79)(H,82,83)/p-1/b10-7-,19-16-,28-25-,31-30-,34-33-/t74-/m1/s1
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCCNC(=O)CCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C77H142NO9P/c1-4-7-10-13-16-19-22-25-28-29-30-31-32-33-34-35-36-37-38-39-40-41-42-43-44-45-48-50-53-56-59-62-65-68-76(80)84-72-74(87-77(81)69-66-63-60-57-54-51-47-27-24-21-18-15-12-9-6-3)73-86-88(82,83)85-71-70-78-75(79)67-64-61-58-55-52-49-46-26-23-20-17-14-11-8-5-2/h7,10,16,19,25,28,30-31,33-34,74H,4-6,8-9,11-15,17-18,20-24,26-27,29,32,35-73H2,1-3H3,(H,78,79)(H,82,83)/b10-7-,19-16-,28-25-,31-30-,34-33-/t74-/m1/s1 Image of MNXM938879
SMILES (mnx)[CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:28]\[CH2:29]/[CH:30]=[CH:31]\[CH2:32]/[CH:33]=[CH:34]\[CH2:35][CH2:36][CH2:37][CH2:38][CH2:39][CH2:40][CH2:41][CH2:42][CH2:43][CH2:44][CH2:45][CH2:48][CH2:50][CH2:53][CH2:56][CH2:59][CH2:62][CH2:65][CH2:68][C:76](=[O:80])[O:84][CH2:72][C@H:74]([CH2:73][O:86][P:88]([OH:82])(=[O:83])[O:85][CH2:71][CH2:70][N:78]=[C:75]([CH2:67][CH2:64][CH2:61][CH2:58][CH2:55][CH2:52][CH2:49][CH2:46][CH2:26][CH2:23][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])[OH:79])[O:87][C:77]([CH2:69][CH2:66][CH2:63][CH2:60][CH2:57][CH2:54][CH2:51][CH2:47][CH2:27][CH2:24][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O: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:000631264
slm:000631264
FKDCYBDCIHGWLW-HPZWFZFKSA-M
1-(21Z,24Z,27Z,30Z,33Z-hexatriacontapentaenoyl)-2-octadecanoyl-sn-glycero-3-phospho-N-octadecanoyl-ethanolamine
N-octadecanoyl-1-(21Z,24Z,27Z,30Z,33Z-hexatriacontapentaenoyl)-2-octadecanoyl-sn-glycero-3-phosphoethanolamine
NAPE (36:5(21Z,24Z,27Z,30Z,33Z)/18:0/18:0)