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CHEBI:201826 - Aranciamycin A

ChEBI IDCHEBI:201826
ChEBI NameAranciamycin A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC26H28O10
Net Charge0
Average Mass500.500
Monoisotopic Mass500.16825
SMILESCOC1C(OC2CC(C)(O)Cc3cc4c(c(O)c32)C(=O)c2c(O)cccc2C4=O)OC(C)C(O)C1O
InChIInChI=1S/C26H28O10/c1-10-19(28)23(32)24(34-3)25(35-10)36-15-9-26(2,33)8-11-7-13-18(21(30)16(11)15)22(31)17-12(20(13)29)5-4-6-14(17)27/h4-7,10,15,19,23-25,27-28,30,32-33H,8-9H2,1-3H3
InChIKeyDEPMSUJGYKZLRC-UHFFFAOYSA-N
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
Aranciamycin A (CHEBI:201826) is a anthracycline (CHEBI:48120)
IUPAC Name 
(7S,9R)-7-[(2R,3R,4R,5R,6S)-4,5-dihydroxy-3-methoxy-6-methyloxan-2-yl]oxy-4,6,9-trihydroxy-9-methyl-8,10-dihydro-7H-tetracene-5,12-dione
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