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CHEBI:182160 - (Stearoyl)adenylate

ChEBI IDCHEBI:182160
ChEBI Name(Stearoyl)adenylate
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SubmitterMetaboLights
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FormulaC28H48N5O8P
Net Charge0
Average Mass613.693
Monoisotopic Mass613.32405
SMILESCCCCCCCCCCCCCCCCCC(=O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O
InChIInChI=1S/C28H48N5O8P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22(34)41-42(37,38)39-18-21-24(35)25(36)28(40-21)33-20-32-23-26(29)30-19-31-27(23)33/h19-21,24-25,28,35-36H,2-18H2,1H3,(H,37,38)(H2,29,30,31)/t21-,24-,25-,28-/m1/s1
InChIKeySWOLRYFPKWBFHG-VGSCBBJJSA-N
ChEBI Ontology
Outgoing Relation(s)
(Stearoyl)adenylate (CHEBI:182160) is a 5'-acylphosphoadenosine (CHEBI:16406)
IUPAC Name 
[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] octadecanoate
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C22132KEGG COMPOUND