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CHEBI:1182 - 2-Ketoepimanool

ChEBI IDCHEBI:1182
ChEBI Name2-Ketoepimanool
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC20H32O2
Net Charge0
Average Mass304.474
Monoisotopic Mass304.24023
SMILES[H][C@]1(CC[C@](C)(O)C=C)C(=C)CC[C@@]2([H])C(C)(C)CC(=O)C[C@]12C
InChIInChI=1S/C20H32O2/c1-7-19(5,22)11-10-16-14(2)8-9-17-18(3,4)12-15(21)13-20(16,17)6/h7,16-17,22H,1-2,8-13H2,3-6H3/t16-,17-,19+,20+/m0/s1
InChIKeyUPIJHQOLJKUYGG-RAUXBKROSA-N
ChEBI Ontology
Outgoing Relation(s)
2-Ketoepimanool (CHEBI:1182) is a diterpenoid (CHEBI:23849)
Synonym  Source
2-KetoepimanoolKEGG COMPOUND
Manual XrefsDatabases
C09124KEGG COMPOUND
C00003449KNApSAcK
Registry NumbersSources
CAS:86561-13-9KEGG COMPOUND