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Phosphatidylglycerophosphate (ditetradecanoyl, n-C14:0)

PropertiesImage
MNX_IDMNXM5272 Image of MNXM5272
referencebiggM:pgp140
formulaC34H66O13P2
global charge-2
mol weight744.837
InChIKeyQNQMHFGHRCVQGM-UHFFFAOYSA-L
InChIInChI=1S/C34H68O13P2/c1-3-5-7-9-11-13-15-17-19-21-23-25-33(36)43-29-32(30-46-49(41,42)45-28-31(35)27-44-48(38,39)40)47-34(37)26-24-22-20-18-16-14-12-10-8-6-4-2/h31-32,35H,3-30H2,1-2H3,(H,41,42)(H2,38,39,40)/p-2
SMILESCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC(O)COP(=O)([O-])O)OC(=O)CCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C34H68O13P2/c1-3-5-7-9-11-13-15-17-19-21-23-25-33(36)43-29-32(30-46-49(41,42)45-28-31(35)27-44-48(38,39)40)47-34(37)26-24-22-20-18-16-14-12-10-8-6-4-2/h31-32,35H,3-30H2,1-2H3,(H,41,42)(H2,38,39,40)/t31?,32? Image of MNXM5272
SMILES (mnx)[CH3:1][CH2:3][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15][CH2:17][CH2:19][CH2:21][CH2:23][CH2:25][C:33](=[O:36])[O:43][CH2:29][CH:32]([CH2:30][O:46][P:49]([OH:41])(=[O:42])[O:45][CH2:28][CH:31]([CH2:27][O:44][P:48]([OH:38])([OH:39])=[O:40])[OH:35])[O:47][C:34]([CH2:26][CH2:24][CH2:22][CH2:20][CH2:18][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:37]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)5
in models (compartimentalized) 7
Similar chemical compounds in external resources
IdentifierDescription

bigg.metabolite:pgp140
biggM:pgp140
vmhM:pgp140
vmhmetabolite:pgp140
QNQMHFGHRCVQGM-UHFFFAOYSA-K
QNQMHFGHRCVQGM-UHFFFAOYSA-L
Phosphatidylglycerophosphate (ditetradecanoyl, n-C14:0)

seed.compound:cpd15543
seedM:cpd15543
QNQMHFGHRCVQGM-UHFFFAOYSA-L
Phosphatidylglycerophosphate ditetradecanoyl
pgp140

biggM:M_pgp140
seedM:M_cpd15543
vmhM:M_pgp140
secondary/obsolete/fantasy identifier