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CHEBI:212349 - Cangumycin A

ChEBI IDCHEBI:212349
ChEBI NameCangumycin A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H20O7
Net Charge0
Average Mass360.362
Monoisotopic Mass360.12090
SMILESC[C@@H]1CC(=O)C2=C(C1)[C@H](O)[C@@H](O)[C@@]1(O)[C@H]2C(=O)c2cccc(O)c2[C@@H]1O
InChIInChI=1S/C19H20O7/c1-7-5-9-12(11(21)6-7)14-15(22)8-3-2-4-10(20)13(8)17(24)19(14,26)18(25)16(9)23/h2-4,7,14,16-18,20,23-26H,5-6H2,1H3/t7-,14+,16-,17-,18+,19+/m0/s1
InChIKeyNFQFDMJGZPLWGI-KCXKHANESA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - DOI (10.1016/S1875-5364(19)30121-9)
ChEBI Ontology
Outgoing Relation(s)
Cangumycin A (CHEBI:212349) is a tetralins (CHEBI:36786)
IUPAC Name 
(3S,5S,6R,6aR,7S,12aS)-5,6,6a,7,8-pentahydroxy-3-methyl-3,4,5,6,7,12a-hexahydro-2H-benzo[a]anthracene-1,12-dione