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CHEBI:189687 - 2''-O-dodecanoyl-ADP-D-ribose(2−)

ChEBI IDCHEBI:189687
ChEBI Name2''-O-dodecanoyl-ADP-D-ribose(2−)
Stars
ASCII Name2''-O-dodecanoyl-ADP-D-ribose(2-)
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC27H43N5O15P2
Net Charge-2
Average Mass739.609
Monoisotopic Mass739.22419
SMILESCCCCCCCCCCCC(=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/C27H45N5O15P2/c1-2-3-4-5-6-7-8-9-10-11-18(33)46-23-21(35)17(45-27(23)37)13-43-49(40,41)47-48(38,39)42-12-16-20(34)22(36)26(44-16)32-15-31-19-24(28)29-14-30-25(19)32/h14-17,20-23,26-27,34-37H,2-13H2,1H3,(H,38,39)(H,40,41)(H2,28,29,30)/p-2/t16-,17-,20-,21-,22-,23-,26-,27?/m1/s1
InChIKeyJNNOTBZHIYZBTB-JVCKPCHYSA-L
ChEBI Ontology
Outgoing Relation(s)
2''-O-dodecanoyl-ADP-D-ribose(2−) (CHEBI:189687) is a O-acyl-ADP-D-ribose(2−) (CHEBI:138087)
UniProt Name  Source
2''-O-dodecanoyl-ADP-D-riboseUniProt