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CHEBI:173712 - Isolubimin

ChEBI IDCHEBI:173712
ChEBI NameIsolubimin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H24O2
Net Charge0
Average Mass236.355
Monoisotopic Mass236.17763
SMILESC=C(C)[C@@H]1CC[C@@]2(C1)[C@@H](CO)CC(=O)C[C@H]2C
InChIInChI=1S/C15H24O2/c1-10(2)12-4-5-15(8-12)11(3)6-14(17)7-13(15)9-16/h11-13,16H,1,4-9H2,2-3H3/t11-,12-,13-,15+/m1/s1
InChIKeyYKAYVNCAHDGJNI-BHPKHCPMSA-N
ChEBI Ontology
Outgoing Relation(s)
Isolubimin (CHEBI:173712) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(3R,5S,6R,10S)-10-(hydroxymethyl)-6-methyl-3-prop-1-en-2-ylspiro[4.5]decan-8-one
Manual XrefsDatabases
10288048ChemSpider
Registry NumbersSources
CAS:60077-68-1ChemIDplus