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CHEBI:204046 - Panglimycin C

ChEBI IDCHEBI:204046
ChEBI NamePanglimycin C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H20O5
Net Charge0
Average Mass328.364
Monoisotopic Mass328.13107
SMILESC[C@H]1CC(=O)C2=C(CC[C@@]3(O)[C@@H]2C(=O)c2cccc(O)c2[C@H]3O)C1
InChIInChI=1S/C19H20O5/c1-9-7-10-5-6-19(24)16(14(10)13(21)8-9)17(22)11-3-2-4-12(20)15(11)18(19)23/h2-4,9,16,18,20,23-24H,5-8H2,1H3/t9-,16+,18-,19-/m1/s1
InChIKeyCRULJZWXPCYLAC-BXXNDXQRSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (18081255)
ChEBI Ontology
Outgoing Relation(s)
Panglimycin C (CHEBI:204046) is a tetralins (CHEBI:36786)
IUPAC Name 
(3R,6aR,7R,12aR)-6a,7,8-trihydroxy-3-methyl-3,4,5,6,7,12a-hexahydro-2H-benzo[a]anthracene-1,12-dione
Manual XrefsDatabases
78440181ChemSpider