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CHEBI:225718 - Xantholipin B

ChEBI IDCHEBI:225718
ChEBI NameXantholipin B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC27H18ClNO9
Net Charge0
Average Mass535.892
Monoisotopic Mass535.06701
SMILESCOc1c(Cl)ccc2c(=O)c3c(O)c4c5c(c3oc12)OCO[C@@H]5Cc1c-4c(O)c2c(=O)nc(C)cc2c1O
InChIInChI=1S/C27H18ClNO9/c1-8-5-10-15(27(34)29-8)21(32)14-11(19(10)30)6-13-16-17(14)22(33)18-20(31)9-3-4-12(28)24(35-2)23(9)38-26(18)25(16)37-7-36-13/h3-5,13,30,32-33H,6-7H2,1-2H3,(H,29,34)/t13-/m1/s1
InChIKeyFRHNWMLBXWSDRM-CYBMUJFWSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (27328868)
ChEBI Ontology
Outgoing Relation(s)
Xantholipin B (CHEBI:225718) is a xanthones (CHEBI:51149)
IUPAC Name 
(13R)-22-chloro-3,10,28-trihydroxy-21-methoxy-7-methyl-14,16,19-trioxa-6-azaheptacyclo[15.11.1.02,11.04,9.013,29.018,27.020,25]nonacosa-1(29),2,4(9),7,10,17,20(25),21,23,27-decaene-5,26-dione
Manual XrefsDatabases
78438784ChemSpider