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CHEBI:74300 - wybutosine 5'-monophosphate

ChEBI IDCHEBI:74300
ChEBI Namewybutosine 5'-monophosphate
Stars
DefinitionA ribonucleotide that is the 5'-monophosphate derivative of wybutosine.
Last Modified23 March 2018
SubmitterSteve
DownloadsMolfile
FormulaC21H29N6O12P
Net Charge0
Average Mass588.467
Monoisotopic Mass588.15811
SMILESCOC(=O)N[C@@H](CCc1c(C)nc2n(C)c3c(ncn3[C@@H]3O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]3O)c(=O)n12)C(=O)OC
InChIInChI=1S/C21H29N6O12P/c1-9-11(6-5-10(19(31)36-3)24-21(32)37-4)27-17(30)13-16(25(2)20(27)23-9)26(8-22-13)18-15(29)14(28)12(39-18)7-38-40(33,34)35/h8,10,12,14-15,18,28-29H,5-7H2,1-4H3,(H,24,32)(H2,33,34,35)/t10-,12+,14+,15+,18+/m0/s1
InChIKeyWOMRPCAFQVCGCI-QHOAOGIMSA-N
ChEBI Ontology
Outgoing Relation(s)
wybutosine 5'-monophosphate (CHEBI:74300) has functional parent guanosine 5'-monophosphate (CHEBI:17345)
wybutosine 5'-monophosphate (CHEBI:74300) is a carbamate ester (CHEBI:23003)
wybutosine 5'-monophosphate (CHEBI:74300) is a methyl ester (CHEBI:25248)
wybutosine 5'-monophosphate (CHEBI:74300) is a organic heterotricyclic compound (CHEBI:26979)
wybutosine 5'-monophosphate (CHEBI:74300) is a ribonucleotide (CHEBI:26561)
Incoming Relation(s)
β-hydroxywybutosine 5'-monophosphate (CHEBI:73622) has functional parent wybutosine 5'-monophosphate (CHEBI:74300)
wybutosine 5'-monophosphate residue (CHEBI:74301) is substituent group from wybutosine 5'-monophosphate (CHEBI:74300)
IUPAC Name 
7-{(3S)-4-methoxy-3-[(methoxycarbonyl)amino]-4-oxobutyl}-4,6-dimethyl-3-(5-O-phosphono-β-D-ribofuranosyl)-3,4-dihydro-9H-imidazo[1,2-a]purin-9-one
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