2'-phospho-cyclic ADP-ribose(3-) (CHEBI:75970)

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CHEBI:75970 - 2'-phospho-cyclic ADP-ribose(3−)

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ChEBI ID	CHEBI:75970
ChEBI Name	2'-phospho-cyclic ADP-ribose(3−)
Stars
ASCII Name	2'-phospho-cyclic ADP-ribose(3-)
Definition	A nucleotide-sugar oxoanion obtained by deprotonation of the diphosphate OH groups of 2'-phospho-cyclic ADP-ribose.
Last Modified	25 October 2013
Submitter	KAX
Downloads	Molfile

Formula	C15H19N5O16P3
Net Charge	-3
Average Mass	618.258
Monoisotopic Mass	618.00561
SMILES	Nc1c2ncn3c2nc[n+]1[C@@H]1O[C@H](COP(=O)([O-])OP(=O)([O-])OC[C@H]2O[C@@H]3[C@H](OP(=O)([O-])[O-])[C@@H]2O)[C@@H](O)[C@H]1O
InChI	InChI=1S/C15H22N5O16P3/c16-12-7-13-18-4-19(12)14-10(23)8(21)5(33-14)1-31-38(27,28)36-39(29,30)32-2-6-9(22)11(35-37(24,25)26)15(34-6)20(13)3-17-7/h3-6,8-11,14-16,21-23H,1-2H2,(H4,24,25,26,27,28,29,30)/p-3/t5-,6-,8-,9-,10-,11-,14-,15-/m1/s1
InChIKey	FUQPZSKOSARDNY-KEOHHSTQSA-K

ChEBI Ontology

Outgoing Relation(s)
	2'-phospho-cyclic ADP-ribose(3−) (CHEBI:75970) has functional parent cyclic ADP-β-D-ribose(2−) (CHEBI:73672)
	2'-phospho-cyclic ADP-ribose(3−) (CHEBI:75970) is a nucleotide-sugar oxoanion (CHEBI:59737)
	2'-phospho-cyclic ADP-ribose(3−) (CHEBI:75970) is conjugate base of 2'-phospho-cyclic ADP-ribose (CHEBI:76081)
Incoming Relation(s)
	2'-phospho-cyclic ADP-ribose (CHEBI:76081) is conjugate acid of 2'-phospho-cyclic ADP-ribose(3−) (CHEBI:75970)

Synonyms	Source
cADPRP	MetaCyc
cyclic adenosine diphosphate ribose phosphate	MetaCyc

UniProt Name	Source
2'-phospho-cyclic ADP-ribose	UniProt

Manual Xrefs	Databases
CPD-15008	MetaCyc

Registry Numbers	Sources
Reaxys:7681029	Reaxys

Citations