EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:189688 - 2''-O-decanoyl-ADP-D-ribose(2−)

Default Structure
ChEBI IDCHEBI:189688
ChEBI Name2''-O-decanoyl-ADP-D-ribose(2−)
Stars
ASCII Name2''-O-decanoyl-ADP-D-ribose(2-)
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC25H39N5O15P2
Net Charge-2
Average Mass711.555
Monoisotopic Mass711.19289
SMILESCCCCCCCCCC(=O)O[C@H]1C(O)O[C@H](COP(=O)([O-])OP(=O)([O-])OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)[C@H](O)[C@@H]2O)[C@H]1O
InChIInChI=1S/C25H41N5O15P2/c1-2-3-4-5-6-7-8-9-16(31)44-21-19(33)15(43-25(21)35)11-41-47(38,39)45-46(36,37)40-10-14-18(32)20(34)24(42-14)30-13-29-17-22(26)27-12-28-23(17)30/h12-15,18-21,24-25,32-35H,2-11H2,1H3,(H,36,37)(H,38,39)(H2,26,27,28)/p-2/t14-,15-,18-,19-,20-,21-,24-,25?/m1/s1
InChIKeyOWVFTUODSKMWAZ-GMCRMSNUSA-L
ChEBI Ontology
Outgoing Relation(s)
2''-O-decanoyl-ADP-D-ribose(2−) (CHEBI:189688) is a O-acyl-ADP-D-ribose(2−) (CHEBI:138087)
UniProt Name  Source
2''-O-decanoyl-ADP-D-riboseUniProt