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CHEBI:103990 - 1,2-ditetradec-7-enoyl-sn-glycero-3-cytidine 5'-diphosphate

ChEBI IDCHEBI:103990
ChEBI Name1,2-ditetradec-7-enoyl-sn-glycero-3-cytidine 5'-diphosphate
Stars
ASCII Name1,2-ditetradec-7-enoyl-sn-glycero-3-cytidine 5'-diphosphate
DefinitionA CDP-diacylglycerol in which the acyl groups at positions 1 and 2 are specified as tetradec-7-enoyl.
Last Modified5 April 2016
DownloadsMolfile
FormulaC40H69N3O15P2
Net Charge0
Average Mass893.946
Monoisotopic Mass893.42039
SMILESCCCCCCC=CCCCCCC(=O)OC[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2ccc(N)nc2=O)[C@H](O)[C@@H]1O)OC(=O)CCCCCC=CCCCCCC
InChIInChI=1S/C40H69N3O15P2/c1-3-5-7-9-11-13-15-17-19-21-23-25-35(44)53-29-32(56-36(45)26-24-22-20-18-16-14-12-10-8-6-4-2)30-54-59(49,50)58-60(51,52)55-31-33-37(46)38(47)39(57-33)43-28-27-34(41)42-40(43)48/h13-16,27-28,32-33,37-39,46-47H,3-12,17-26,29-31H2,1-2H3,(H,49,50)(H,51,52)(H2,41,42,48)/t32-,33-,37-,38-,39-/m1/s1
InChIKeyVDJIEKQUDMPHPA-WNAWUNHNSA-N
Species of MetaboliteComponentSourceComments
Mycoplasma genitalium (ncbitaxon:2097) - PubMed (22817898)
Roles Classification
Biological Roles:
Mycoplasma genitalium metabolite  Any bacterial metabolite produced during a metabolic reaction in Mycoplasma genitalium.
Escherichia coli metabolite  Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
ChEBI Ontology
Outgoing Relation(s)
1,2-ditetradec-7-enoyl-sn-glycero-3-cytidine 5'-diphosphate (CHEBI:103990) has role Mycoplasma genitalium metabolite (CHEBI:131604)
1,2-ditetradec-7-enoyl-sn-glycero-3-cytidine 5'-diphosphate (CHEBI:103990) is a CDP-diacylglycerol (CHEBI:17962)
IUPAC Name 
5'-O-[{[{(2R)-2,3-bis[(tetradec-9-enoyl)oxy]propoxy}(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]cytidine
Synonyms  Source
CDP-1,2-ditetradec-7-enoylglycerolChEBI
CDP-DG(14:1/14:1)ChEBI
CDP-1,2-ditetradec-7-enoyl-sn-glycerolChEBI
Citations