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CHEBI:75866 - d(AA·TT)

Default Structure
ChEBI IDCHEBI:75866
ChEBI Named(AA·TT)
Stars
ASCII Named(AA.TT)
Last Modified9 October 2013
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC20H25N10O8P.C20H27N4O12P
Net Charge0
Average Mass1110.882
Monoisotopic Mass1110.29575
SMILESCc1cn([C@H]2C[C@H](OP(=O)(O)OC[C@H]3O[C@@H](n4cc(C)c(=O)nc4=O)C[C@@H]3O)[C@@H](CO)O2)c(=O)nc1=O.Nc1ncnc2c1ncn2[C@H]1C[C@H](OP(=O)(O)OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)C[C@@H]2O)[C@@H](CO)O1
InChIInChI=1S/C20H25N10O8P.C20H27N4O12P/c21-17-15-19(25-5-23-17)29(7-27-15)13-1-9(32)12(37-13)4-35-39(33,34)38-10-2-14(36-11(10)3-31)30-8-28-16-18(22)24-6-26-20(16)30;1-9-5-23(19(29)21-17(9)27)15-3-11(26)14(35-15)8-33-37(31,32)36-12-4-16(34-13(12)7-25)24-6-10(2)18(28)22-20(24)30/h5-14,31-32H,1-4H2,(H,33,34)(H2,21,23,25)(H2,22,24,26);5-6,11-16,25-26H,3-4,7-8H2,1-2H3,(H,31,32)(H,21,27,29)(H,22,28,30)/t9-,10-,11+,12+,13+,14+;11-,12-,13+,14+,15+,16+/m00/s1
InChIKeyPGNIQBPZCFZONM-HAFFMEJHSA-N
ChEBI Ontology
Outgoing Relation(s)
d(AA·TT) (CHEBI:75866) is a unclassifieds (CHEBI:27189)