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CHEBI:215908 - Monacyclinone B

ChEBI IDCHEBI:215908
ChEBI NameMonacyclinone B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC27H27NO6
Net Charge0
Average Mass461.514
Monoisotopic Mass461.18384
SMILESCc1cc(O)c2c3c(cc(O)c2c1)C(=O)c1c(ccc([C@H]2CC[C@H](N(C)C)[C@H](C)O2)c1O)C3=O
InChIInChI=1S/C27H27NO6/c1-12-9-16-19(29)11-17-23(22(16)20(30)10-12)26(32)15-6-5-14(25(31)24(15)27(17)33)21-8-7-18(28(3)4)13(2)34-21/h5-6,9-11,13,18,21,29-31H,7-8H2,1-4H3/t13-,18-,21+/m0/s1
InChIKeyLCNXLRHNCJLJRN-LTBCBRHQSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (26230704)
Roles Classification
Biological Role:
bacterial metabolite  Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
ChEBI Ontology
Outgoing Relation(s)
Monacyclinone B (CHEBI:215908) is a angucycline (CHEBI:48130)
IUPAC Name 
9-[(2R,5S,6S)-5-(dimethylamino)-6-methyloxan-2-yl]-1,5,8-trihydroxy-3-methylbenzo[a]anthracene-7,12-dione
Manual XrefsDatabases
40256515ChemSpider