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CHEBI:82476 - Hydroxysenkirkine

ChEBI IDCHEBI:82476
ChEBI NameHydroxysenkirkine
Stars
DownloadsMolfile
FormulaC19H28NO7
Net Charge+1
Average Mass382.433
Monoisotopic Mass382.18603
SMILES[H][C@]12CC[N+]3(C)CC=C(COC(=O)[C@@](O)(CO)[C@H](C)C/C(=C/C)C(=O)O1)[C@]23O
InChIInChI=1S/C19H28NO7/c1-4-13-9-12(2)18(24,11-21)17(23)26-10-14-5-7-20(3)8-6-15(19(14,20)25)27-16(13)22/h4-5,12,15,21,24-25H,6-11H2,1-3H3/q+1/b13-4-/t12-,15-,18-,19+,20?/m1/s1
InChIKeyCRWHRMSWJOLABX-NXWCFRFGSA-N
ChEBI Ontology
Outgoing Relation(s)
Hydroxysenkirkine (CHEBI:82476) is a citraconoyl group (CHEBI:23315)
Manual XrefsDatabases
C19435KEGG COMPOUND
Registry NumbersSources
CAS:26782-43-4KEGG COMPOUND