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CHEBI:57863 - ADP-D-glycero-D-manno-heptose(2−)

ChEBI IDCHEBI:57863
ChEBI NameADP-D-glycero-D-manno-heptose(2−)
Stars
ASCII NameADP-D-glycero-D-manno-heptose(2-)
DefinitionDianion of ADP-D-glycero-D-manno-heptose; major species at pH 7.3.
Last Modified25 September 2015
DownloadsMolfile
FormulaC17H25N5O16P2
Net Charge-2
Average Mass617.354
Monoisotopic Mass617.07825
SMILES[H][C@]1([C@H](O)CO)OC(OP(=O)([O-])OP(=O)([O-])OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)[C@H](O)[C@@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O
InChIInChI=1S/C17H27N5O16P2/c18-14-7-15(20-3-19-14)22(4-21-7)16-11(28)8(25)6(35-16)2-34-39(30,31)38-40(32,33)37-17-12(29)9(26)10(27)13(36-17)5(24)1-23/h3-6,8-13,16-17,23-29H,1-2H2,(H,30,31)(H,32,33)(H2,18,19,20)/p-2/t5-,6-,8-,9+,10+,11-,12+,13-,16-,17?/m1/s1
InChIKeyKMSFWBYFWSKGGR-RQWOTHMISA-L
ChEBI Ontology
Outgoing Relation(s)
ADP-D-glycero-D-manno-heptose(2−) (CHEBI:57863) is a nucleotide-sugar oxoanion (CHEBI:59737)
ADP-D-glycero-D-manno-heptose(2−) (CHEBI:57863) is conjugate base of ADP-D-glycero-D-manno-heptose (CHEBI:16693)
Incoming Relation(s)
ADP-D-glycero-D-manno-heptose (CHEBI:16693) is conjugate acid of ADP-D-glycero-D-manno-heptose(2−) (CHEBI:57863)
IUPAC Name 
adenine 5'-[3-(D-glycero-D-manno-heptopyranosyl) diphosphate]
Synonym  Source
ADP-D-glycero-D-manno-heptose dianionChEBI