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CHEBI:202223 - 5beta,10alpha-dihydroxy-1-orsellinate-dihydromelleolide

ChEBI IDCHEBI:202223
ChEBI Name5beta,10alpha-dihydroxy-1-orsellinate-dihydromelleolide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H30O7
Net Charge0
Average Mass418.486
Monoisotopic Mass418.19915
SMILESCc1cc(O)cc(O)c1C(=O)OCC1=C[C@@H]2CC(C)(C)[C@H](O)C2[C@@]2(C)C[C@@H](O)[C@@]12O
InChIInChI=1S/C23H30O7/c1-11-5-14(24)7-15(25)17(11)20(28)30-10-13-6-12-8-21(2,3)19(27)18(12)22(4)9-16(26)23(13,22)29/h5-7,12,16,18-19,24-27,29H,8-10H2,1-4H3/t12-,16-,18?,19-,22-,23+/m1/s1
InChIKeyOEBGQVIRXPDBGY-DEVYZCKTSA-N
Species of MetaboliteComponentSourceComments
Armillaria tabescens (ncbitaxon:47431) - DOI (10.1016/S0031-9422(96)00599-7)
ChEBI Ontology
Outgoing Relation(s)
5beta,10alpha-dihydroxy-1-orsellinate-dihydromelleolide (CHEBI:202223) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
[(2R,2aS,4aS,7R,7bR)-2,2a,7-trihydroxy-6,6,7b-trimethyl-1,2,4a,5,7,7a-hexahydrocyclobuta[e]inden-3-yl]methyl 2,4-dihydroxy-6-methylbenzoate
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78436839ChemSpider