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CHEBI:31050 - 104-1

ChEBI IDCHEBI:31050
ChEBI Name104-1
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC25H24O9
Net Charge0
Average Mass468.458
Monoisotopic Mass468.14203
SMILESC[C@H]1O[C@@H](c2ccc3c(c2O)C(=O)c2c(O)cc4c(c2C3=O)C(=O)C[C@](C)(O)C4)C[C@@H](O)[C@@H]1O
InChIInChI=1S/C25H24O9/c1-9-21(29)14(27)6-16(34-9)11-3-4-12-18(22(11)30)24(32)19-13(26)5-10-7-25(2,33)8-15(28)17(10)20(19)23(12)31/h3-5,9,14,16,21,26-27,29-30,33H,6-8H2,1-2H3/t9-,14-,16-,21-,25-/m1/s1
InChIKeyRPINDSDUVXDEGE-WUZSHGJPSA-N
Roles Classification
Biological Role:
bacterial metabolite  Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
ChEBI Ontology
Outgoing Relation(s)
104-1 (CHEBI:31050) is a angucycline (CHEBI:48130)
Synonym  Source
104-1KEGG COMPOUND
Manual XrefsDatabases
C12403KEGG COMPOUND