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CHEBI:81237 - Cinncassiol C3

Default Structure
ChEBI IDCHEBI:81237
ChEBI NameCinncassiol C3
Stars
DownloadsMolfile
FormulaC20H30O7
Net Charge0
Average Mass382.453
Monoisotopic Mass382.19915
SMILESCC(C)[C@@]1(O)CC(=O)[C@@]2(C)C[C@]3(O)O[C@]4(C(=O)[C@@]31C)[C@H](O)[C@@H](C)CC[C@@]42O
InChIInChI=1S/C20H30O7/c1-10(2)17(24)8-12(21)15(4)9-19(26)16(17,5)14(23)20(27-19)13(22)11(3)6-7-18(15,20)25/h10-11,13,22,24-26H,6-9H2,1-5H3/t11-,13+,15?,16+,17-,18-,19-,20-/m0/s1
InChIKeyIJPNDQQOKFKBRG-ZPZYUIKSSA-N
ChEBI Ontology
Outgoing Relation(s)
Cinncassiol C3 (CHEBI:81237) is a sesquiterpenoid (CHEBI:26658)
Manual XrefsDatabases
C17641KEGG COMPOUND