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CHEBI:217905 - Kiamycin B

ChEBI IDCHEBI:217905
ChEBI NameKiamycin B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H22O6
Net Charge0
Average Mass358.390
Monoisotopic Mass358.14164
SMILESCOc1cccc2c1[C@@H](O)[C@@]1(O)[C@@H]3CC4=C(C(=O)C[C@](C)(O)C4)[C@H]1[C@H]2O3
InChIInChI=1S/C20H22O6/c1-19(23)7-9-6-13-20(24)16(14(9)11(21)8-19)17(26-13)10-4-3-5-12(25-2)15(10)18(20)22/h3-5,13,16-18,22-24H,6-8H2,1-2H3/t13-,16-,17-,18+,19+,20+/m0/s1
InChIKeyOYXKPETZJCTWDM-GYDQMFFNSA-N
Species of MetaboliteComponentSourceComments
Streptomyces griseus (ncbitaxon:1911) - DOI (10.1016/j.tetlet.2018.04.063)
ChEBI Ontology
Outgoing Relation(s)
Kiamycin B (CHEBI:217905) is a tetralins (CHEBI:36786)
IUPAC Name 
(1S,5R,9S,11R,18R,19R)-5,18,19-trihydroxy-16-methoxy-5-methyl-10-oxapentacyclo[9.8.0.02,7.09,19.012,17]nonadeca-2(7),12(17),13,15-tetraen-3-one
Manual XrefsDatabases
71048997ChemSpider