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1-(19Z,22Z,25Z,28Z,31Z-tetratriacontapentaenoyl)-2-(21Z,24Z,27Z,30Z-hexatriacontatetraenoyl)-sn-glycero-3-phospho-N-(11Z-octadecenoyl)-ethanolamine

PropertiesImage
MNX_IDMNXM938325 Image of MNXM938325
referenceslm:000630710
formulaC93H163NO9P
global charge-1
mol weight1470.299
InChIKeyAGOUHXGNSSIXFW-KLJRPZSFSA-M
InChIInChI=1S/C93H164NO9P/c1-4-7-10-13-16-19-22-25-28-30-32-34-36-38-40-42-44-45-47-49-51-53-55-57-59-61-64-67-70-73-76-79-82-85-93(97)103-90(89-102-104(98,99)101-87-86-94-91(95)83-80-77-74-71-68-65-62-27-24-21-18-15-12-9-6-3)88-100-92(96)84-81-78-75-72-69-66-63-60-58-56-54-52-50-48-46-43-41-39-37-35-33-31-29-26-23-20-17-14-11-8-5-2/h8,11,16-17,19-21,24-26,28-29,32-35,38-41,90H,4-7,9-10,12-15,18,22-23,27,30-31,36-37,42-89H2,1-3H3,(H,94,95)(H,98,99)/p-1/b11-8-,19-16-,20-17-,24-21-,28-25-,29-26-,34-32-,35-33-,40-38-,41-39-/t90-/m1/s1
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCCNC(=O)CCCCCCCCC/C=C\CCCCCC)OC(=O)CCCCCCCCCCCCCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC
MNX internals
InChI (mnx)InChI=1/C93H164NO9P/c1-4-7-10-13-16-19-22-25-28-30-32-34-36-38-40-42-44-45-47-49-51-53-55-57-59-61-64-67-70-73-76-79-82-85-93(97)103-90(89-102-104(98,99)101-87-86-94-91(95)83-80-77-74-71-68-65-62-27-24-21-18-15-12-9-6-3)88-100-92(96)84-81-78-75-72-69-66-63-60-58-56-54-52-50-48-46-43-41-39-37-35-33-31-29-26-23-20-17-14-11-8-5-2/h8,11,16-17,19-21,24-26,28-29,32-35,38-41,90H,4-7,9-10,12-15,18,22-23,27,30-31,36-37,42-89H2,1-3H3,(H,94,95)(H,98,99)/b11-8-,19-16-,20-17-,24-21-,28-25-,29-26-,34-32-,35-33-,40-38-,41-39-/t90-/m1/s1 Image of MNXM938325
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:28]\[CH2:30]/[CH:32]=[CH:34]\[CH2:36]/[CH:38]=[CH:40]\[CH2:42][CH2:44][CH2:45][CH2:47][CH2:49][CH2:51][CH2:53][CH2:55][CH2:57][CH2:59][CH2:61][CH2:64][CH2:67][CH2:70][CH2:73][CH2:76][CH2:79][CH2:82][CH2:85][C:93](=[O:97])[O:103][C@H:90]([CH2:88][O:100][C:92]([CH2:84][CH2:81][CH2:78][CH2:75][CH2:72][CH2:69][CH2:66][CH2:63][CH2:60][CH2:58][CH2:56][CH2:54][CH2:52][CH2:50][CH2:48][CH2:46][CH2:43]/[CH:41]=[CH:39]\[CH2:37]/[CH:35]=[CH:33]\[CH2:31]/[CH:29]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14]/[CH:11]=[CH:8]\[CH2:5][CH3:2])=[O:96])[CH2:89][O:102][P:104]([OH:98])(=[O:99])[O:101][CH2:87][CH2:86][N:94]=[C:91]([CH2:83][CH2:80][CH2:77][CH2:74][CH2:71][CH2:68][CH2:65][CH2:62][CH2:27]/[CH:24]=[CH:21]\[CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])[OH:95]
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:000630710
slm:000630710
AGOUHXGNSSIXFW-KLJRPZSFSA-M
1-(19Z,22Z,25Z,28Z,31Z-tetratriacontapentaenoyl)-2-(21Z,24Z,27Z,30Z-hexatriacontatetraenoyl)-sn-glycero-3-phospho-N-(11Z-octadecenoyl)-ethanolamine
N-(11Z-octadecenoyl)-1-(19Z,22Z,25Z,28Z,31Z-tetratriacontapentaenoyl)-2-(21Z,24Z,27Z,30Z-hexatriacontatetraenoyl)-sn-glycero-3-phosphoethanolamine
NAPE (34:5(19Z,22Z,25Z,28Z,31Z)/36:4(21Z,24Z,27Z,30Z)/18:1(11Z))