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CHEBI:222890 - Lichenicolin B

ChEBI IDCHEBI:222890
ChEBI NameLichenicolin B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC33H26O13
Net Charge0
Average Mass630.558
Monoisotopic Mass630.13734
SMILESCOc1cc2cc3c(c(O)c2c(O)c1C1=C(O)c2c(cc4c(c2O)C(=O)O[C@@H]2C[C@@H](C)O[C@H]42)C(=O)C1=O)C(=O)O[C@@H]1C[C@@H](C)O[C@H]31
InChIInChI=1S/C33H26O13/c1-9-4-16-30(43-9)13-6-11-7-15(42-3)22(26(36)18(11)25(35)20(13)32(40)45-16)23-28(38)19-12(24(34)29(23)39)8-14-21(27(19)37)33(41)46-17-5-10(2)44-31(14)17/h6-10,16-17,30-31,35-38H,4-5H2,1-3H3/t9-,10-,16-,17-,30-,31-/m1/s1
InChIKeyFUPVZZMBEOVWCT-CWFVKZMHSA-N
ChEBI Ontology
Outgoing Relation(s)
Lichenicolin B (CHEBI:222890) is a organic heterotricyclic compound (CHEBI:26979)
Lichenicolin B (CHEBI:222890) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
(11R,13R,15R)-5-[(11R,13R,15R)-2,4-dihydroxy-6-methoxy-13-methyl-17-oxo-12,16-dioxatetracyclo[8.7.0.03,8.011,15]heptadeca-1(10),2,4,6,8-pentaen-5-yl]-2,4-dihydroxy-13-methyl-12,16-dioxatetracyclo[8.7.0.03,8.011,15]heptadeca-1,3(8),4,9-tetraene-6,7,17-trione
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