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CHEBI:211258 - Arimetamycin B

ChEBI IDCHEBI:211258
ChEBI NameArimetamycin B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H28O12
Net Charge0
Average Mass544.509
Monoisotopic Mass544.15808
SMILESCOc1cc(O)c2c(c1)C(=O)c1cc3c(c(O)c1C2=O)[C@@H](O[C@H]1C[C@H](O)[C@@H](O)[C@H](C)O1)[C@H](OC)[C@](C)(O)C3=O
InChIInChI=1S/C27H28O12/c1-9-20(30)15(29)8-16(38-9)39-24-19-13(25(34)27(2,35)26(24)37-4)7-12-18(23(19)33)22(32)17-11(21(12)31)5-10(36-3)6-14(17)28/h5-7,9,15-16,20,24,26,28-30,33,35H,8H2,1-4H3/t9-,15-,16-,20-,24+,26-,27+/m0/s1
InChIKeyIOBWMUZXCVXZEC-NFPJALKISA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (24038656)
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)
Arimetamycin B (CHEBI:211258) is a anthracycline (CHEBI:48120)
IUPAC Name 
(2S,3S,4R)-4-[(2S,4S,5R,6S)-4,5-dihydroxy-6-methyloxan-2-yl]oxy-2,5,7-trihydroxy-3,9-dimethoxy-2-methyl-3,4-dihydrotetracene-1,6,11-trione
Manual XrefsDatabases
78439844ChemSpider