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CHEBI:142720 - N2-(ADP-D-ribosyl)-dGTP(6−)

ChEBI IDCHEBI:142720
ChEBI NameN2-(ADP-D-ribosyl)-dGTP(6−)
Stars
ASCII NameN(2)-(ADP-D-ribosyl)-dGTP(6-)
DefinitionMajor species at pH 7.3.
Last Modified27 February 2024
SubmitterAnne Morgat
DownloadsMolfile
FormulaC25H31N10O26P5
Net Charge-6
Average Mass1042.437
Monoisotopic Mass1042.01320
SMILESNc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)([O-])OP(=O)([O-])OC[C@H]2OC(Nc3nc(=O)c4ncn([C@H]5C[C@H](O)[C@@H](COP(=O)([O-])OP(=O)([O-])OP(=O)([O-])[O-])O5)c4n3)[C@H](O)[C@@H]2O)[C@@H](O)[C@H]1O
InChIInChI=1S/C25H37N10O26P5/c26-19-13-20(28-5-27-19)35(7-29-13)24-18(40)16(38)11(58-24)4-55-64(47,48)60-63(45,46)54-3-10-15(37)17(39)23(57-10)33-25-31-21-14(22(41)32-25)30-6-34(21)12-1-8(36)9(56-12)2-53-65(49,50)61-66(51,52)59-62(42,43)44/h5-12,15-18,23-24,36-40H,1-4H2,(H,45,46)(H,47,48)(H,49,50)(H,51,52)(H2,26,27,28)(H2,42,43,44)(H2,31,32,33,41)/p-6/t8-,9+,10+,11+,12+,15+,16+,17+,18+,23?,24+/m0/s1
InChIKeyITFDGIOHXPGDQF-LEGLRYGTSA-H
ChEBI Ontology
Outgoing Relation(s)
N2-(ADP-D-ribosyl)-dGTP(6−) (CHEBI:142720) has functional parent ADP-D-ribose(2−) (CHEBI:57967)
N2-(ADP-D-ribosyl)-dGTP(6−) (CHEBI:142720) has functional parent dGTP(4−) (CHEBI:61429)
N2-(ADP-D-ribosyl)-dGTP(6−) (CHEBI:142720) is a nucleotide-sugar oxoanion (CHEBI:59737)
UniProt Name  Source
N2-(ADP-D-ribosyl)-dGTPUniProt