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CHEBI:192469 - trans-sinapoyl-AMP(1−)

ChEBI IDCHEBI:192469
ChEBI Nametrans-sinapoyl-AMP(1−)
Stars
ASCII Nametrans-sinapoyl-AMP(1-)
SubmitterElisabeth Coudert
DownloadsMolfile
FormulaC21H23N5O11P
Net Charge-1
Average Mass552.413
Monoisotopic Mass552.11372
SMILESCOc1cc(/C=C/C(=O)OP(=O)([O-])OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)[C@H](O)[C@@H]2O)cc(OC)c1O
InChIInChI=1S/C21H24N5O11P/c1-33-11-5-10(6-12(34-2)16(11)28)3-4-14(27)37-38(31,32)35-7-13-17(29)18(30)21(36-13)26-9-25-15-19(22)23-8-24-20(15)26/h3-6,8-9,13,17-18,21,28-30H,7H2,1-2H3,(H,31,32)(H2,22,23,24)/p-1/b4-3+/t13-,17-,18-,21-/m1/s1
InChIKeyIEHUREDUHQQSOO-ZSYRKKTNSA-M
ChEBI Ontology
Outgoing Relation(s)
trans-sinapoyl-AMP(1−) (CHEBI:192469) has functional parent trans-sinapate (CHEBI:30023)
trans-sinapoyl-AMP(1−) (CHEBI:192469) has functional parent adenosine 5'-monophosphate (CHEBI:16027)
trans-sinapoyl-AMP(1−) (CHEBI:192469) is a organophosphate oxoanion (CHEBI:58945)
UniProt Name  Source
(E)-sinapoyl-AMPUniProt