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1-O-(1Z,9Z,12Z-octadecatrienyl)-2-triacontanoyl-sn-glycero-3-phospho-N-(11Z-octadecenoyl)-ethanolamine

PropertiesImage
MNX_IDMNXM1023631 Image of MNXM1023631
referenceslm:000716020
formulaC71H133NO8P
global charge-1
mol weight1159.818
InChIKeyWHOUNDVPZSCMOH-HDMUUHKNSA-M
InChIInChI=1S/C71H134NO8P/c1-4-7-10-13-16-19-22-25-28-30-31-32-33-34-35-36-37-38-39-40-42-45-48-51-54-57-60-63-71(74)80-69(67-77-65-61-58-55-52-49-46-43-29-26-23-20-17-14-11-8-5-2)68-79-81(75,76)78-66-64-72-70(73)62-59-56-53-50-47-44-41-27-24-21-18-15-12-9-6-3/h17,20-21,24,26,29,61,65,69H,4-16,18-19,22-23,25,27-28,30-60,62-64,66-68H2,1-3H3,(H,72,73)(H,75,76)/p-1/b20-17-,24-21-,29-26-,65-61-/t69-/m1/s1
SMILESCCCCC/C=C\C/C=C\CCCCCC/C=C\OC[C@H](COP(=O)([O-])OCCNC(=O)CCCCCCCCC/C=C\CCCCCC)OC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C71H134NO8P/c1-4-7-10-13-16-19-22-25-28-30-31-32-33-34-35-36-37-38-39-40-42-45-48-51-54-57-60-63-71(74)80-69(67-77-65-61-58-55-52-49-46-43-29-26-23-20-17-14-11-8-5-2)68-79-81(75,76)78-66-64-72-70(73)62-59-56-53-50-47-44-41-27-24-21-18-15-12-9-6-3/h17,20-21,24,26,29,61,65,69H,4-16,18-19,22-23,25,27-28,30-60,62-64,66-68H2,1-3H3,(H,72,73)(H,75,76)/b20-17-,24-21-,29-26-,65-61-/t69-/m1/s1 Image of MNXM1023631
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22][CH2:25][CH2:28][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH2:39][CH2:40][CH2:42][CH2:45][CH2:48][CH2:51][CH2:54][CH2:57][CH2:60][CH2:63][C:71](=[O:74])[O:80][C@H:69]([CH2:67][O:77]/[CH:65]=[CH:61]\[CH2:58][CH2:55][CH2:52][CH2:49][CH2:46][CH2:43]/[CH:29]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])[CH2:68][O:79][P:81]([OH:75])(=[O:76])[O:78][CH2:66][CH2:64][N:72]=[C:70]([CH2:62][CH2:59][CH2:56][CH2:53][CH2:50][CH2:47][CH2:44][CH2:41][CH2:27]/[CH:24]=[CH:21]\[CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])[OH:73]
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:000716020
slm:000716020
WHOUNDVPZSCMOH-HDMUUHKNSA-M
1-O-(1Z,9Z,12Z-octadecatrienyl)-2-triacontanoyl-sn-glycero-3-phospho-N-(11Z-octadecenoyl)-ethanolamine
N-(11Z-octadecenoyl)-1-O-(1Z,9Z,12Z-octadecatrienyl)-2-triacontanoyl-sn-glycero-3-phosphoethanolamine
NAPE (P-18:2(9Z,12Z)/30:0/18:1(11Z))