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1-(9Z,12Z,15Z-octadecatrienoyl)-2-(13-methyltetradecanoyl)-sn-glycero-3-phosphate

PropertiesImage
MNX_IDMNXM319075 Image of MNXM319075
referenceslm:000024975
formulaC36H63O8P
global charge-2
mol weight654.866
InChIKeyKTLYDGXJHUXURA-JWWAFDQFSA-L
InChIInChI=1S/C36H65O8P/c1-4-5-6-7-8-9-10-11-12-13-14-17-20-23-26-29-35(37)42-31-34(32-43-45(39,40)41)44-36(38)30-27-24-21-18-15-16-19-22-25-28-33(2)3/h5-6,8-9,11-12,33-34H,4,7,10,13-32H2,1-3H3,(H2,39,40,41)/p-2/b6-5-,9-8-,12-11-/t34-/m1/s1
SMILESCC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])[O-])OC(=O)CCCCCCCCCCCC(C)C
MNX internals
InChI (mnx)InChI=1/C36H65O8P/c1-4-5-6-7-8-9-10-11-12-13-14-17-20-23-26-29-35(37)42-31-34(32-43-45(39,40)41)44-36(38)30-27-24-21-18-15-16-19-22-25-28-33(2)3/h5-6,8-9,11-12,33-34H,4,7,10,13-32H2,1-3H3,(H2,39,40,41)/b6-5-,9-8-,12-11-/t34-/m1/s1 Image of MNXM319075
SMILES (mnx)[CH3:1][CH2:4]/[CH:5]=[CH:6]\[CH2:7]/[CH:8]=[CH:9]\[CH2:10]/[CH:11]=[CH:12]\[CH2:13][CH2:14][CH2:17][CH2:20][CH2:23][CH2:26][CH2:29][C:35](=[O:37])[O:42][CH2:31][C@H:34]([CH2:32][O:43][P:45]([OH:39])([OH:40])=[O:41])[O:44][C:36]([CH2:30][CH2:27][CH2:24][CH2:21][CH2:18][CH2:15][CH2:16][CH2:19][CH2:22][CH2:25][CH2:28][CH:33]([CH3:2])[CH3:3])=[O:38]
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:000024975
slm:000024975
KTLYDGXJHUXURA-JWWAFDQFSA-L
1-(9Z,12Z,15Z-octadecatrienoyl)-2-(13-methyltetradecanoyl)-sn-glycero-3-phosphate
PA(18:3(9Z,12Z,15Z)/15:0)
Phosphatidate (18:3(9Z,12Z,15Z)/15:0)