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CHEBI:210954 - (1S,4R,5S,7R,10R)-guaiane-4,5,10,11,12-pentaol

ChEBI IDCHEBI:210954
ChEBI Name(1S,4R,5S,7R,10R)-guaiane-4,5,10,11,12-pentaol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H28O5
Net Charge0
Average Mass288.384
Monoisotopic Mass288.19367
SMILESCC(O)(CO)[C@@H]1CC[C@@](C)(O)[C@@H]2CC[C@@](C)(O)[C@]2(O)C1
InChIInChI=1S/C15H28O5/c1-12(17)6-4-10(13(2,18)9-16)8-15(20)11(12)5-7-14(15,3)19/h10-11,16-20H,4-9H2,1-3H3/t10-,11+,12-,13?,14-,15+/m1/s1
InChIKeyRVOYPHQNQKKDCU-UWOCAKRYSA-N
Species of MetaboliteComponentSourceComments
Xylaria (ncbitaxon:37991) - PubMed (26265580)
ChEBI Ontology
Outgoing Relation(s)
(1S,4R,5S,7R,10R)-guaiane-4,5,10,11,12-pentaol (CHEBI:210954) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(1R,3aS,4R,7R,8aS)-7-(1,2-dihydroxypropan-2-yl)-1,4-dimethyl-3,3a,5,6,7,8-hexahydro-2H-azulene-1,4,8a-triol
Manual XrefsDatabases
78441100ChemSpider