Feedback

ADP-D-ribose 1'',2''-cyclic phosphate

Properties

Image

Occurences in reactions

MNX_ID

MNXM6154

	#reac
in my sandbox	0
in MNXref (generic)	6
in models (compartimentalized)	1

formula

C₁₅H₁₉N₅O₁₆P₃

charge

-3

mass

618.00561

reference

chebi:76596

InChIKey

NPSPRYXPOGPCPM-KEOHHSTQSA-K

InChI

InChI=1S/C15H22N5O16P3/c16-12-7-13(18-3-17-12)20(4-19-7)14-10(23)8(21)5(32-14)1-30-37(24,25)36-38(26,27)31-2-6-9(22)11-15(33-6)35-39(28,29)34-11/h3-6,8-11,14-15,21-23H,1-2H2,(H,24,25)(H,26,27)(H,28,29)(H2,16,17,18)/p-3/t5-,6-,8-,9-,10-,11-,14-,15-/m1/s1

SMILES

Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)([O-])OP(=O)([O-])OC[C@H]2O[C@@H]3OP(=O)([O-])O[C@@H]3[C@@H]2O)[C@@H](O)[C@H]1O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:76596 chebi:76596	ADP-D-ribose 1'',2''-cyclic phosphate ADP-D-ribose 1'',2''-cyclic phosphate(3-)
metacyc.compound:CPD-9007 metacycM:CPD-9007	ADP ribose 1'',2''-cyclic phosphate ADP ribose 1'',2''-phosphate ADP ribose 1''-2''-cyclic phosphate Appr>p adenosine diphosphate ribose 1'',2''-cyclic phosphate
CHEBI:48582 chebi:48582	ADP-D-ribose 1'',2''-cyclic phosphate ADP-ribose 1'',2''-cyclic phosphate ADP-ribose 1''-2'' cyclic phosphate Appr>p adenosine 5'-[3-(1,2-O-phospho-alpha-D-ribofuranos-5-O-yl) dihydrogen diphosphate]
seed.compound:cpd21093 seedM:cpd21093	ADP-ribose 1'',2''-phosphate ADP ribose 1'',2''-cyclic phosphate ADP ribose 1'',2''-phosphate ADP ribose 1''-2''-cyclic phosphate ADP-ribose 1",2"-cyclic phosphate Appr>p adenosine diphosphate ribose 1'',2''-cyclic phosphate
kegg.compound:C19851 keggC:C19851	ADP-ribose 1'',2''-phosphate ADP-ribose 1",2"-cyclic phosphate
sabiork.compound:27431 sabiorkM:27431	ADPribose 1'',2''-cyclic phosphate
keggC:M_C19851 seedM:M_cpd21093	secondary/obsolete/fantasy identifier