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CHEBI:175864 - Sugetriol triacetate

ChEBI IDCHEBI:175864
ChEBI NameSugetriol triacetate
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SubmitterMetaboLights
DownloadsMolfile
FormulaC21H30O6
Net Charge0
Average Mass378.465
Monoisotopic Mass378.20424
SMILES[H][C@@]12C[C@H](OC(C)=O)[C@@H](C)[C@]3(C[C@H](OC(C)=O)C(C)=C3[C@H]1OC(C)=O)C2(C)C
InChIInChI=1S/C21H30O6/c1-10-17(26-13(4)23)9-21-11(2)16(25-12(3)22)8-15(20(21,6)7)19(18(10)21)27-14(5)24/h11,15-17,19H,8-9H2,1-7H3/t11-,15-,16+,17+,19+,21+/m1/s1
InChIKeyLCYMMMXHRHJXJB-ZHOQLOPFSA-N
ChEBI Ontology
Outgoing Relation(s)
Sugetriol triacetate (CHEBI:175864) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
[(1R,3S,6S,7S,9S,10S)-3,6-diacetyloxy-4,10,11,11-tetramethyl-9-tricyclo[5.3.1.01,5]undec-4-enyl] acetate
Manual XrefsDatabases
103882619ChemSpider