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CHEBI:8209 - Pilosine

ChEBI IDCHEBI:8209
ChEBI NamePilosine
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC16H18N2O3
Net Charge0
Average Mass286.331
Monoisotopic Mass286.13174
SMILES[H][C@@]1([C@@H](O)c2ccccc2)C(=O)OC[C@@H]1Cc1cncn1C
InChIInChI=1S/C16H18N2O3/c1-18-10-17-8-13(18)7-12-9-21-16(20)14(12)15(19)11-5-3-2-4-6-11/h2-6,8,10,12,14-15,19H,7,9H2,1H3/t12-,14+,15-/m0/s1
InChIKeyDZOVBAVEJYPSLL-CFVMTHIKSA-N
ChEBI Ontology
Outgoing Relation(s)
Pilosine (CHEBI:8209) is a citraconoyl group (CHEBI:23315)
Synonym  Source
PilosineKEGG COMPOUND
Manual XrefsDatabases
C10610KEGG COMPOUND
C00002356KNApSAcK
Registry NumbersSources
CAS:13640-28-3KEGG COMPOUND