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4-CDP-2-C-methyl-D-erythritol

MNXM730950 is deprecated and replaced by MNXM730948

Properties

Image

Occurences in reactions

MNX_ID

MNXM730948

	#reac
in my sandbox	0
in MNXref (generic)	4
in models (compartimentalized)	6

formula

C₁₄H₂₃N₃O₁₄P₂

charge

-2

mass

519.06662

reference

chebi:57823

InChIKey

YFAUKWZNPVBCFF-XHIBXCGHSA-L

InChI

InChI=1S/C14H25N3O14P2/c1-14(23,6-18)8(19)5-29-33(26,27)31-32(24,25)28-4-7-10(20)11(21)12(30-7)17-3-2-9(15)16-13(17)22/h2-3,7-8,10-12,18-21,23H,4-6H2,1H3,(H,24,25)(H,26,27)(H2,15,16,22)/p-2/t7-,8-,10-,11-,12-,14+/m1/s1

SMILES

C[C@](O)(CO)[C@H](O)COP(=O)([O-])OP(=O)([O-])OC[C@H]1O[C@@H](n2ccc(N)nc2=O)[C@H](O)[C@@H]1O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:57823 chebi:57823	4-CDP-2-C-methyl-D-erythritol 4-CDP-2-C-methyl-D-erythritol dianion 4-CDP-2-C-methyl-D-erythritol(2-) 5'-O-{[({[(2R,3S)-2,3,4-trihydroxy-3-methylbutyl]oxy}phosphinato)oxy]phosphinato}cytidine cytidine 5'-{3-[(2R,3S)-2,3,4-trihydroxy-3-methylbutyl] diphosphate}
sabiork.compound:13502 sabiorkM:13502 kegg.compound:C11435 keggC:C11435	4-(Cytidine 5'-diphospho)-2-C-methyl-D-erythritol
bigg.metabolite:4c2me biggM:4c2me	4-(cytidine 5'-diphospho)-2-C-methyl-D-erythritol
metacyc.compound:4-CYTIDINE-5-DIPHOSPHO-2-C metacycM:4-CYTIDINE-5-DIPHOSPHO-2-C	4-(cytidine 5'-diphospho)-2-C-methyl-D-erythritol 4-diphosphocytidyl-2-C-methylerythritol 4-diphosphocytidyl-2C-methyl-D-erythritol CDP-ME CDP-methyl-D-erythritol
seed.compound:cpd08287 seedM:cpd08287	4--cytidine5-diphospho-2-C-methyl-D-erythritol 4-(Cytidine 5'-diphospho)-2-C-methyl-D-erythritol 4-(cytidine 5'-diphospho)-2-C-methyl-D-erythritol 4-diphosphocytidyl-2-C-methylerythritol 4-diphosphocytidyl-2C-methyl-D-erythritol 4c2me CDP-ME CDP-methyl-D-erythritol
CHEBI:16578 chebi:16578	4-CDP-2-C-methyl-D-erythritol 4-(Cytidine 5'-diphospho)-2-C-methyl-D-erythritol cytidine 5'-{3-[(2R,3S)-2,3,4-trihydroxy-3-methylbutyl] dihydrogen diphosphate}
chebi:11938 chebi:1770 biggM:M_4c2me keggC:M_C11435 seedM:M_cpd08287	secondary/obsolete/fantasy identifier