Search MNXref
 Feedback

1-(10Z,13Z,16Z-docosatrienoyl)-2-(14Z,17Z,20Z,23Z,26Z-dotriacontapentaenoyl)-sn-glycero-3-phosphate

PropertiesImage
MNX_IDMNXM182595 Image of MNXM182595
referenceslm:000496864
formulaC57H95O8P
global charge-2
mol weight939.353
InChIKeyINMHOEJFISBSDW-MPDXIJSCSA-L
InChIInChI=1S/C57H97O8P/c1-3-5-7-9-11-13-15-17-19-21-23-24-25-26-27-28-29-30-31-32-34-36-38-40-42-44-46-48-50-52-57(59)65-55(54-64-66(60,61)62)53-63-56(58)51-49-47-45-43-41-39-37-35-33-22-20-18-16-14-12-10-8-6-4-2/h11-14,17-20,23-24,26-27,29-30,33,35,55H,3-10,15-16,21-22,25,28,31-32,34,36-54H2,1-2H3,(H2,60,61,62)/p-2/b13-11-,14-12-,19-17-,20-18-,24-23-,27-26-,30-29-,35-33-/t55-/m1/s1
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCC/C=C\C/C=C\C/C=C\CCCCC)COP(=O)([O-])[O-]
MNX internals
InChI (mnx)InChI=1/C57H97O8P/c1-3-5-7-9-11-13-15-17-19-21-23-24-25-26-27-28-29-30-31-32-34-36-38-40-42-44-46-48-50-52-57(59)65-55(54-64-66(60,61)62)53-63-56(58)51-49-47-45-43-41-39-37-35-33-22-20-18-16-14-12-10-8-6-4-2/h11-14,17-20,23-24,26-27,29-30,33,35,55H,3-10,15-16,21-22,25,28,31-32,34,36-54H2,1-2H3,(H2,60,61,62)/b13-11-,14-12-,19-17-,20-18-,24-23-,27-26-,30-29-,35-33-/t55-/m1/s1 Image of MNXM182595
SMILES (mnx)[CH3:1][CH2:3][CH2:5][CH2:7][CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:17]=[CH:19]\[CH2:21]/[CH:23]=[CH:24]\[CH2:25]/[CH:26]=[CH:27]\[CH2:28]/[CH:29]=[CH:30]\[CH2:31][CH2:32][CH2:34][CH2:36][CH2:38][CH2:40][CH2:42][CH2:44][CH2:46][CH2:48][CH2:50][CH2:52][C:57](=[O:59])[O:65][C@H:55]([CH2:53][O:63][C:56]([CH2:51][CH2:49][CH2:47][CH2:45][CH2:43][CH2:41][CH2:39][CH2:37]/[CH:35]=[CH:33]\[CH2:22]/[CH:20]=[CH:18]\[CH2:16]/[CH:14]=[CH:12]\[CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:58])[CH2:54][O:64][P:66]([OH:60])([OH:61])=[O:62]
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:000496864
slm:000496864
INMHOEJFISBSDW-MPDXIJSCSA-L
1-(10Z,13Z,16Z-docosatrienoyl)-2-(14Z,17Z,20Z,23Z,26Z-dotriacontapentaenoyl)-sn-glycero-3-phosphate
PA(22:3(10Z,13Z,16Z)/32:5(14Z,17Z,20Z,23Z,26Z))
Phosphatidate (22:3(10Z,13Z,16Z)/32:5(14Z,17Z,20Z,23Z,26Z))