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CHEBI:202718 - (rel)-4beta,8-dihydroxy-3alpha-O-[alpha-glucopyranosyl]hydroxymethyl-4alpha-methyl-1,2,3,4-tetrahydronaphthalene-1-one

ChEBI IDCHEBI:202718
ChEBI Name(rel)-4beta,8-dihydroxy-3alpha-O-[alpha-glucopyranosyl]hydroxymethyl-4alpha-methyl-1,2,3,4-tetrahydronaphthalene-1-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H24O9
Net Charge0
Average Mass384.381
Monoisotopic Mass384.14203
SMILESC[C@@]1(O)c2cccc(O)c2C(=O)C[C@H]1CO[C@H]1O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]1O
InChIInChI=1S/C18H24O9/c1-18(25)8(5-11(21)13-9(18)3-2-4-10(13)20)7-26-17-16(24)15(23)14(22)12(6-19)27-17/h2-4,8,12,14-17,19-20,22-25H,5-7H2,1H3/t8-,12-,14+,15-,16+,17-,18-/m0/s1
InChIKeyOUJUSXTWROPUKU-SPVXRFLKSA-N
Species of MetaboliteComponentSourceComments
Streptomyces rimosus (ncbitaxon:1927) - PubMed (16506700)
ChEBI Ontology
Outgoing Relation(s)
(rel)-4beta,8-dihydroxy-3alpha-O-[alpha-glucopyranosyl]hydroxymethyl-4alpha-methyl-1,2,3,4-tetrahydronaphthalene-1-one (CHEBI:202718) is a glycoside (CHEBI:24400)
IUPAC Name 
(3S,4S)-4,8-dihydroxy-4-methyl-3-[[(2S,3R,4S,5S,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-2,3-dihydronaphthalen-1-one
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78439644ChemSpider