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CHEBI:81533 - 2''-Adenylylgentamicin A

ChEBI IDCHEBI:81533
ChEBI Name2''-Adenylylgentamicin A
Stars
DownloadsMolfile
FormulaC28H48N9O16P
Net Charge0
Average Mass797.713
Monoisotopic Mass797.29566
SMILESCN[C@@H]1[C@@H](OP(=O)(O)OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)[C@H](O)[C@@H]2O)[C@@H](O[C@@H]2[C@@H](O)[C@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3N)[C@@H](N)C[C@H]2N)OC[C@H]1O
InChIInChI=1S/C28H48N9O16P/c1-33-14-10(39)4-47-28(52-22-9(30)2-8(29)21(20(22)44)51-27-13(31)18(42)16(40)11(3-38)50-27)23(14)53-54(45,46)48-5-12-17(41)19(43)26(49-12)37-7-36-15-24(32)34-6-35-25(15)37/h6-14,16-23,26-28,33,38-44H,2-5,29-31H2,1H3,(H,45,46)(H2,32,34,35)/t8-,9+,10+,11+,12+,13+,14-,16+,17+,18+,19+,20-,21+,22-,23+,26+,27+,28+/m0/s1
InChIKeyVNYFJZQRMVOPNW-SWPLHRKISA-N
ChEBI Ontology
Outgoing Relation(s)
2''-Adenylylgentamicin A (CHEBI:81533) is a purine ribonucleoside monophosphate (CHEBI:26397)
Manual XrefsDatabases
C18136KEGG COMPOUND