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CHEBI:206486 - Frenolicin E

ChEBI IDCHEBI:206486
ChEBI NameFrenolicin E
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SubmitterMetaboLights
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FormulaC18H20O8
Net Charge0
Average Mass364.350
Monoisotopic Mass364.11582
SMILESCCC[C@H]1O[C@H](CC(=O)O)C[C@]2(O)C(=O)c3cccc(O)c3C(=O)[C@@]12O
InChIInChI=1S/C18H20O8/c1-2-4-12-18(25)16(23)14-10(5-3-6-11(14)19)15(22)17(18,24)8-9(26-12)7-13(20)21/h3,5-6,9,12,19,24-25H,2,4,7-8H2,1H3,(H,20,21)/t9-,12-,17+,18+/m1/s1
InChIKeyXDYYASNFOIEXFT-LGIYFBNJSA-N
Species of MetaboliteComponentSourceComments
Streptomycesspecies RM-4-15 (ncbitaxon:1337050) - PubMed (23944931)
ChEBI Ontology
Outgoing Relation(s)
Frenolicin E (CHEBI:206486) is a benzochromenone (CHEBI:64986)
Frenolicin E (CHEBI:206486) is a glycoside (CHEBI:24400)
IUPAC Name 
2-[(1R,3S,4aR,10aR)-4a,9,10a-trihydroxy-5,10-dioxo-1-propyl-3,4-dihydro-1H-benzo[g]isochromen-3-yl]acetic acid
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