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1-butanoyl-2-(11-methyldodecanoyl)-sn-glycero-3-phosphate

PropertiesImage
MNX_IDMNXM343393 Image of MNXM343393
referenceslm:000025581
formulaC20H37O8P
global charge-2
mol weight436.482
InChIKeyYBMMTCRACLBWGN-GOSISDBHSA-L
InChIInChI=1S/C20H39O8P/c1-4-12-19(21)26-15-18(16-27-29(23,24)25)28-20(22)14-11-9-7-5-6-8-10-13-17(2)3/h17-18H,4-16H2,1-3H3,(H2,23,24,25)/p-2/t18-/m1/s1
SMILESCCCC(=O)OC[C@H](COP(=O)([O-])[O-])OC(=O)CCCCCCCCCC(C)C
MNX internals
InChI (mnx)InChI=1/C20H39O8P/c1-4-12-19(21)26-15-18(16-27-29(23,24)25)28-20(22)14-11-9-7-5-6-8-10-13-17(2)3/h17-18H,4-16H2,1-3H3,(H2,23,24,25)/t18-/m1/s1 Image of MNXM343393
SMILES (mnx)[CH3:1][CH2:4][CH2:12][C:19](=[O:21])[O:26][CH2:15][C@H:18]([CH2:16][O:27][P:29]([OH:23])([OH:24])=[O:25])[O:28][C:20]([CH2:14][CH2:11][CH2:9][CH2:7][CH2:5][CH2:6][CH2:8][CH2:10][CH2:13][CH:17]([CH3:2])[CH3:3])=[O:22]
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:000025581
slm:000025581
YBMMTCRACLBWGN-GOSISDBHSA-L
1-butanoyl-2-(11-methyldodecanoyl)-sn-glycero-3-phosphate
PA(4:0/13:0)
Phosphatidate (4:0/13:0)