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CHEBI:2741 - Annofoline

ChEBI IDCHEBI:2741
ChEBI NameAnnofoline
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC16H25NO2
Net Charge0
Average Mass263.381
Monoisotopic Mass263.18853
SMILES[H][C@@]12CCCN3CCC[C@]4([H])[C@H](C[C@H]1O)C(=O)[C@H](C)C[C@]324
InChIInChI=1S/C16H25NO2/c1-10-9-16-12-4-2-6-17(16)7-3-5-13(16)14(18)8-11(12)15(10)19/h10-14,18H,2-9H2,1H3/t10-,11+,12-,13-,14-,16-/m1/s1
InChIKeyKYIYXWHVYGBAKF-NVWMEEMDSA-N
ChEBI Ontology
Outgoing Relation(s)
Annofoline (CHEBI:2741) is a sesquiterpenoid (CHEBI:26658)
Synonym  Source
AnnofolineKEGG COMPOUND
Manual XrefsDatabases
C09851KEGG COMPOUND
C00027867KNApSAcK
C00001931KNApSAcK
Registry NumbersSources
CAS:664-23-3KEGG COMPOUND