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CHEBI:213283 - 2beta,3beta,13-trihydroxyledol

ChEBI IDCHEBI:213283
ChEBI Name2beta,3beta,13-trihydroxyledol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H26O4
Net Charge0
Average Mass270.369
Monoisotopic Mass270.18311
SMILESC[C@@H]1[C@@H](O)[C@@H](O)[C@H]2[C@@H]1[C@H]1[C@@H](CC[C@@]2(C)O)[C@]1(C)CO
InChIInChI=1S/C15H26O4/c1-7-9-10-8(14(10,2)6-16)4-5-15(3,19)11(9)13(18)12(7)17/h7-13,16-19H,4-6H2,1-3H3/t7-,8+,9-,10+,11+,12+,13-,14-,15+/m0/s1
InChIKeyQTKRWDZJFVCCLA-DWFLYGMXSA-N
Species of MetaboliteComponentSourceComments
Dichomitus squalens (ncbitaxon:114155) - DOI (10.1002/hlca.201000328)
ChEBI Ontology
Outgoing Relation(s)
2beta,3beta,13-trihydroxyledol (CHEBI:213283) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(1S,1aR,4R,4aR,5S,6R,7S,7aR,7bS)-1-(hydroxymethyl)-1,4,7-trimethyl-2,3,4a,5,6,7,7a,7b-octahydro-1aH-cyclopropa[e]azulene-4,5,6-triol
Manual XrefsDatabases
78441513ChemSpider