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CHEBI:142724 - 1''-O-acetyl-ADP-D-ribose(2−)

ChEBI IDCHEBI:142724
ChEBI Name1''-O-acetyl-ADP-D-ribose(2−)
Stars
ASCII Name1''-O-acetyl-ADP-D-ribose(2-)
DefinitionA nucleotide-sugar oxoanion arising from deprotonation of the diphosphate OH groups of 1''-O-acetyl-ADP-D-ribose; major species at pH 7.3.
SubmitterAnne Morgat
DownloadsMolfile
FormulaC17H23N5O15P2
Net Charge-2
Average Mass599.339
Monoisotopic Mass599.06769
SMILESCC(=O)OC1O[C@H](COP(=O)([O-])OP(=O)([O-])OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)[C@H](O)[C@@H]2O)[C@@H](O)[C@H]1O
InChIInChI=1S/C17H25N5O15P2/c1-6(23)34-17-13(27)11(25)8(36-17)3-33-39(30,31)37-38(28,29)32-2-7-10(24)12(26)16(35-7)22-5-21-9-14(18)19-4-20-15(9)22/h4-5,7-8,10-13,16-17,24-27H,2-3H2,1H3,(H,28,29)(H,30,31)(H2,18,19,20)/p-2/t7-,8-,10-,11-,12-,13-,16-,17?/m1/s1
InChIKeyIJOUKWCBVUMMCR-YDKGJHSESA-L
ChEBI Ontology
Outgoing Relation(s)
1''-O-acetyl-ADP-D-ribose(2−) (CHEBI:142724) is a nucleotide-sugar oxoanion (CHEBI:59737)
Incoming Relation(s)
1''-O-acetyl-ADP-α-D-ribose(2−) (CHEBI:142511) is a 1''-O-acetyl-ADP-D-ribose(2−) (CHEBI:142724)
UniProt Name  Source
1''-O-acetyl-ADP-D-riboseUniProt