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CHEBI:223402 - Termstrin B

ChEBI IDCHEBI:223402
ChEBI NameTermstrin B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC21H18O9
Net Charge0
Average Mass414.366
Monoisotopic Mass414.09508
SMILESCC(=O)OC(C(=O)O)C(C)Cc1c(O)cc2c(c1O)C(=O)c1cccc(O)c1C2=O
InChIInChI=1S/C21H18O9/c1-8(20(21(28)29)30-9(2)22)6-11-14(24)7-12-16(18(11)26)17(25)10-4-3-5-13(23)15(10)19(12)27/h3-5,7-8,20,23-24,26H,6H2,1-2H3,(H,28,29)
InChIKeyVEUNAESIPFZBLD-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (32533072)
ChEBI Ontology
Outgoing Relation(s)
Termstrin B (CHEBI:223402) is a hydroxyanthraquinones (CHEBI:37485)
IUPAC Name 
2-acetyloxy-3-methyl-4-(1,3,5-trihydroxy-9,10-dioxoanthracen-2-yl)butanoic acid