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CHEBI:60282 - α-N-acetyllysine-N6,N6-dimethyladenosine 5'-phosphomorpholidate

ChEBI IDCHEBI:60282
ChEBI Nameα-N-acetyllysine-N6,N6-dimethyladenosine 5'-phosphomorpholidate
Stars
ASCII Namealpha-N-acetyllysine-N(6),N(6)-dimethyladenosine 5'-phosphomorpholidate
DefinitionA phosphorodiamidate ester of N,N-dimethyladenosine in which the NR2 groups on phosphorus are morpholino and N2-acetyl-N5-L-lysino.
Last Modified23 September 2010
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC24H39N8O9P
Net Charge0
Average Mass614.597
Monoisotopic Mass614.25776
SMILESCC(=O)N[C@@H](CCCCNP(=O)(OC[C@H]1O[C@@H](n2cnc3c(N(C)C)ncnc32)[C@H](O)[C@@H]1O)N1CCOCC1)C(=O)O
InChIInChI=1S/C24H39N8O9P/c1-15(33)29-16(24(36)37)6-4-5-7-28-42(38,31-8-10-39-11-9-31)40-12-17-19(34)20(35)23(41-17)32-14-27-18-21(30(2)3)25-13-26-22(18)32/h13-14,16-17,19-20,23,34-35H,4-12H2,1-3H3,(H,28,38)(H,29,33)(H,36,37)/t16-,17+,19+,20+,23+,42?/m0/s1
InChIKeyFFXICWHONZATJD-WECBVBOJSA-N
ChEBI Ontology
Outgoing Relation(s)
α-N-acetyllysine-N6,N6-dimethyladenosine 5'-phosphomorpholidate (CHEBI:60282) is a adenosines (CHEBI:22260)
α-N-acetyllysine-N6,N6-dimethyladenosine 5'-phosphomorpholidate (CHEBI:60282) is a phosphorodiamidate ester (CHEBI:60284)
IUPAC Name 
5'-O-{[(5S)-5-acetamido-5-carboxypentylamino](morpholin-4-yl)phosphoryl}-N,N-dimethyladenosine
Citations