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3-ADP-glycerate

Properties

Image

Occurences in reactions

MNX_ID

MNXM4324

	#reac
in my sandbox	0
in MNXref (generic)	1
in models (compartimentalized)	0

formula

C₁₃H₁₆N₅O₁₃P₂

charge

-3

mass

512.02363

reference

chebi:57800

InChIKey

APVQTUURIRQYIT-NRJACJQQSA-K

InChI

InChI=1S/C13H19N5O13P2/c14-10-7-11(16-3-15-10)18(4-17-7)12-9(21)8(20)6(30-12)2-29-33(26,27)31-32(24,25)28-1-5(19)13(22)23/h3-6,8-9,12,19-21H,1-2H2,(H,22,23)(H,24,25)(H,26,27)(H2,14,15,16)/p-3/t5?,6-,8-,9-,12-/m1/s1

SMILES

Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)([O-])OP(=O)([O-])OCC(O)C(=O)[O-])[C@@H](O)[C@H]1O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:57800 chebi:57800	3-ADP-glycerate 3-ADP-glycerate trianion 3-ADP-glycerate(3-) 5'-O-({[(2-carboxylato-2-hydroxyethoxy)phosphinato]oxy}phosphinato)adenosine adenosine 5'-[3-(2-carboxylato-2-hydroxyethyl) diphosphate]
kegg.compound:C02509 keggC:C02509	3-(ADP)-glycerate
seed.compound:cpd01650 seedM:cpd01650	3-(ADP)-glycerate 3-ADP-glycerate
metacyc.compound:3-ADPGLYCERATE metacycM:3-ADPGLYCERATE	3-ADP-glycerate
CHEBI:16515 chebi:16515	3-ADP-glyceric acid 3-(ADP)-glycerate 3-{[(adenosin-5'-yl)(hydroxy)phosphoryloxy](hydroxy)phosphoryloxy}-2-hydroxypropanoic acid adenosine 5'-[3-(2-carboxy-2-hydroxyethyl) dihydrogen diphosphate]
chebi:11733 chebi:1434 chebi:19937 keggC:M_C02509 seedM:M_cpd01650	secondary/obsolete/fantasy identifier