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

PropertiesImage
MNX_IDMNXM938822 Image of MNXM938822
referenceslm:000631207
formulaC67H121NO9P
global charge-1
mol weight1115.677
InChIKeyKLIVIRSSBPSIQH-HQZGUVHWSA-M
InChIInChI=1S/C67H122NO9P/c1-4-7-10-13-16-18-20-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38-39-40-41-43-45-47-50-52-55-58-66(70)74-62-64(77-67(71)59-56-53-48-15-12-9-6-3)63-76-78(72,73)75-61-60-68-65(69)57-54-51-49-46-44-42-21-19-17-14-11-8-5-2/h7,10,16,18,22-23,25-26,28-29,64H,4-6,8-9,11-15,17,19-21,24,27,30-63H2,1-3H3,(H,68,69)(H,72,73)/p-1/b10-7-,18-16-,23-22-,26-25-,29-28-/t64-/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)CCCCCCCCCCCCCCC)OC(=O)CCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C67H122NO9P/c1-4-7-10-13-16-18-20-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38-39-40-41-43-45-47-50-52-55-58-66(70)74-62-64(77-67(71)59-56-53-48-15-12-9-6-3)63-76-78(72,73)75-61-60-68-65(69)57-54-51-49-46-44-42-21-19-17-14-11-8-5-2/h7,10,16,18,22-23,25-26,28-29,64H,4-6,8-9,11-15,17,19-21,24,27,30-63H2,1-3H3,(H,68,69)(H,72,73)/b10-7-,18-16-,23-22-,26-25-,29-28-/t64-/m1/s1 Image of MNXM938822
SMILES (mnx)[CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:16]=[CH:18]\[CH2:20]/[CH:22]=[CH:23]\[CH2:24]/[CH:25]=[CH:26]\[CH2:27]/[CH:28]=[CH:29]\[CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH2:39][CH2:40][CH2:41][CH2:43][CH2:45][CH2:47][CH2:50][CH2:52][CH2:55][CH2:58][C:66](=[O:70])[O:74][CH2:62][C@H:64]([CH2:63][O:76][P:78]([OH:72])(=[O:73])[O:75][CH2:61][CH2:60][N:68]=[C:65]([CH2:57][CH2:54][CH2:51][CH2:49][CH2:46][CH2:44][CH2:42][CH2:21][CH2:19][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])[OH:69])[O:77][C:67]([CH2:59][CH2:56][CH2:53][CH2:48][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:71]
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:000631207
slm:000631207
KLIVIRSSBPSIQH-HQZGUVHWSA-M
1-(21Z,24Z,27Z,30Z,33Z-hexatriacontapentaenoyl)-2-decanoyl-sn-glycero-3-phospho-N-hexadecanoyl-ethanolamine
N-hexadecanoyl-1-(21Z,24Z,27Z,30Z,33Z-hexatriacontapentaenoyl)-2-decanoyl-sn-glycero-3-phosphoethanolamine
NAPE (36:5(21Z,24Z,27Z,30Z,33Z)/10:0/16:0)