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CHEBI:64076 - (S)-NADPHX(4−)

ChEBI IDCHEBI:64076
ChEBI Name(S)-NADPHX(4−)
Stars
ASCII Name(S)-NADPHX(4-)
DefinitionA quadruply-charged nucleotide-sugar oxoanion obtained by deprotonation of the diphosphate OH groups of (S)-NADPHX; major species at pH 7.3.
Last Modified2 August 2018
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC21H28N7O18P3
Net Charge-4
Average Mass759.408
Monoisotopic Mass759.07256
SMILESNC(=O)C1=CN([C@@H]2O[C@H](COP(=O)([O-])OP(=O)([O-])OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)([O-])[O-])[C@@H]3O)[C@@H](O)[C@H]2O)[C@@H](O)CC1
InChIInChI=1S/C21H32N7O18P3/c22-17-12-19(25-6-24-17)28(7-26-12)21-16(45-47(34,35)36)14(31)10(44-21)5-42-49(39,40)46-48(37,38)41-4-9-13(30)15(32)20(43-9)27-3-8(18(23)33)1-2-11(27)29/h3,6-7,9-11,13-16,20-21,29-32H,1-2,4-5H2,(H2,23,33)(H,37,38)(H,39,40)(H2,22,24,25)(H2,34,35,36)/p-4/t9-,10-,11+,13-,14-,15-,16-,20-,21-/m1/s1
InChIKeySZKXTJUOKARGIY-VPHRTNKSSA-J
ChEBI Ontology
Outgoing Relation(s)
(S)-NADPHX(4−) (CHEBI:64076) has functional parent NADPH(4−) (CHEBI:57783)
(S)-NADPHX(4−) (CHEBI:64076) is a nucleotide-sugar oxoanion (CHEBI:59737)
(S)-NADPHX(4−) (CHEBI:64076) is conjugate base of (S)-NADPHX (CHEBI:64084)
Incoming Relation(s)
(S)-NADPHX (CHEBI:64084) is conjugate acid of (S)-NADPHX(4−) (CHEBI:64076)
UniProt Name  Source
(6S)-NADPHXUniProt
Manual XrefsDatabases
CPD0-2474MetaCyc
Citations