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CHEBI:199482 - 8,2'-Demethoxy-steffimycin C

ChEBI IDCHEBI:199482
ChEBI Name8,2'-Demethoxy-steffimycin C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H28O11
Net Charge0
Average Mass516.499
Monoisotopic Mass516.16316
SMILESCOc1cc(O)c2c(c1)C(=O)c1cc3c(c(O)c1C2=O)[C@@H](OC1OC(C)C(O)C(O)C1O)C[C@](C)(O)C3
InChIInChI=1S/C26H28O11/c1-9-19(28)23(32)24(33)25(36-9)37-15-8-26(2,34)7-10-4-12-18(21(30)16(10)15)22(31)17-13(20(12)29)5-11(35-3)6-14(17)27/h4-6,9,15,19,23-25,27-28,30,32-34H,7-8H2,1-3H3/t9?,15-,19?,23?,24?,25?,26+/m0/s1
InChIKeyGBILMBMWCHCXLJ-WJEWAYCESA-N
Species of MetaboliteComponentSourceComments
Streptomyces steffisburgensis (ncbitaxon:68271) - PubMed (9268006)
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)
8,2'-Demethoxy-steffimycin C (CHEBI:199482) is a anthracycline (CHEBI:48120)
IUPAC Name 
(7S,9R)-4,6,9-trihydroxy-2-methoxy-9-methyl-7-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-8,10-dihydro-7H-tetracene-5,12-dione
Manual XrefsDatabases
78445658ChemSpider