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2-Acyl-sn-glycero-3-phosphoglycerol (n-C14:1)

PropertiesImage
MNX_IDMNXM3452 Image of MNXM3452
referencebiggM:2agpg141
formulaC20H38O9P
global charge-1
mol weight453.489
InChIKeyJPZRBXGDTBKBHT-UHFFFAOYSA-M
InChIInChI=1S/C20H39O9P/c1-2-3-4-5-6-7-8-9-10-11-12-13-20(24)27-15-19(23)17-29-30(25,26)28-16-18(22)14-21/h7-8,18-19,21-23H,2-6,9-17H2,1H3,(H,25,26)/p-1
SMILESCCCCCCC=CCCCCCC(=O)OCC(O)COP(=O)([O-])OCC(O)CO
MNX internals
InChI (mnx)InChI=1/C20H39O9P/c1-2-3-4-5-6-7-8-9-10-11-12-13-20(24)27-15-19(23)17-29-30(25,26)28-16-18(22)14-21/h7-8,18-19,21-23H,2-6,9-17H2,1H3,(H,25,26)/b8-7?/t18?,19? Image of MNXM3452
SMILES (mnx)[CH3:1][CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH:7]=[CH:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][C:20](=[O:24])[O:27][CH2:15][CH:19]([CH2:17][O:29][P:30]([OH:25])(=[O:26])[O:28][CH2:16][CH:18]([CH2:14][OH:21])[OH:22])[OH:23]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)5
in models (compartimentalized) 6
Similar chemical compounds in external resources
IdentifierDescription

bigg.metabolite:2agpg141
biggM:2agpg141
JPZRBXGDTBKBHT-UHFFFAOYSA-M
2-Acyl-sn-glycero-3-phosphoglycerol (n-C14:1)

biggM:M_2agpg141
secondary/obsolete/fantasy identifier