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1-butanoyl-2-(8Z,11Z,14Z-eicosatrienoyl)-sn-glycero-3-phosphate

PropertiesImage
MNX_IDMNXM344093 Image of MNXM344093
referenceslm:000025626
formulaC27H45O8P
global charge-2
mol weight528.623
InChIKeySBPBVNIJMOKPTD-HRWDJORISA-L
InChIInChI=1S/C27H47O8P/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-27(29)35-25(24-34-36(30,31)32)23-33-26(28)21-4-2/h8-9,11-12,14-15,25H,3-7,10,13,16-24H2,1-2H3,(H2,30,31,32)/p-2/b9-8-,12-11-,15-14-/t25-/m1/s1
SMILESCCCCC/C=C\C/C=C\C/C=C\CCCCCCC(=O)O[C@H](COC(=O)CCC)COP(=O)([O-])[O-]
MNX internals
InChI (mnx)InChI=1/C27H47O8P/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-27(29)35-25(24-34-36(30,31)32)23-33-26(28)21-4-2/h8-9,11-12,14-15,25H,3-7,10,13,16-24H2,1-2H3,(H2,30,31,32)/b9-8-,12-11-,15-14-/t25-/m1/s1 Image of MNXM344093
SMILES (mnx)[CH3:1][CH2:3][CH2:5][CH2:6][CH2:7]/[CH:8]=[CH:9]\[CH2:10]/[CH:11]=[CH:12]\[CH2:13]/[CH:14]=[CH:15]\[CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:22][C:27](=[O:29])[O:35][C@H:25]([CH2:23][O:33][C:26]([CH2:21][CH2:4][CH3:2])=[O:28])[CH2:24][O:34][P:36]([OH:30])([OH:31])=[O:32]
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:000025626
slm:000025626
SBPBVNIJMOKPTD-HRWDJORISA-L
1-butanoyl-2-(8Z,11Z,14Z-eicosatrienoyl)-sn-glycero-3-phosphate
PA(4:0/20:3(8Z,11Z,14Z))
Phosphatidate (4:0/20:3(8Z,11Z,14Z))