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1-butanoyl-2-(13Z,16Z-docosadienoyl)-sn-glycero-3-phosphate

PropertiesImage
MNX_IDMNXM343575 Image of MNXM343575
referenceslm:000025593
formulaC29H51O8P
global charge-2
mol weight558.693
InChIKeyXNXZAHYYFHYHAS-NAOBVMBLSA-L
InChIInChI=1S/C29H53O8P/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-24-29(31)37-27(26-36-38(32,33)34)25-35-28(30)23-4-2/h8-9,11-12,27H,3-7,10,13-26H2,1-2H3,(H2,32,33,34)/p-2/b9-8-,12-11-/t27-/m1/s1
SMILESCCCCC/C=C\C/C=C\CCCCCCCCCCCC(=O)O[C@H](COC(=O)CCC)COP(=O)([O-])[O-]
MNX internals
InChI (mnx)InChI=1/C29H53O8P/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-24-29(31)37-27(26-36-38(32,33)34)25-35-28(30)23-4-2/h8-9,11-12,27H,3-7,10,13-26H2,1-2H3,(H2,32,33,34)/b9-8-,12-11-/t27-/m1/s1 Image of MNXM343575
SMILES (mnx)[CH3:1][CH2:3][CH2:5][CH2:6][CH2:7]/[CH:8]=[CH:9]\[CH2:10]/[CH:11]=[CH:12]\[CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:24][C:29](=[O:31])[O:37][C@H:27]([CH2:25][O:35][C:28]([CH2:23][CH2:4][CH3:2])=[O:30])[CH2:26][O:36][P:38]([OH:32])([OH:33])=[O:34]
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:000025593
slm:000025593
XNXZAHYYFHYHAS-NAOBVMBLSA-L
1-butanoyl-2-(13Z,16Z-docosadienoyl)-sn-glycero-3-phosphate
PA(4:0/22:2(13Z,16Z))
Phosphatidate (4:0/22:2(13Z,16Z))