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CHEBI:209429 - L-rhodinose-2-deoxy-L-fucose-2-deoxy-L-fucose-10-decarbomethoxy-epsilon-rhodomycinone

ChEBI IDCHEBI:209429
ChEBI NameL-rhodinose-2-deoxy-L-fucose-2-deoxy-L-fucose-10-decarbomethoxy-epsilon-rhodomycinone
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC38H48O15
Net Charge0
Average Mass744.787
Monoisotopic Mass744.29932
SMILESCC[C@]1(O)Cc2c(O)c3c(c(O)c2[C@@H](O[C@H]2C[C@H](O)[C@H](O[C@H]4C[C@H](O)[C@H](O[C@H]5CC[C@H](O)[C@H](C)O5)[C@H](C)O4)[C@H](C)O2)C1)C(=O)c1c(O)cccc1C3=O
InChIInChI=1S/C38H48O15/c1-5-38(47)13-19-29(35(46)31-30(33(19)44)32(43)18-7-6-8-21(40)28(18)34(31)45)24(14-38)51-26-11-22(41)37(17(4)49-26)53-27-12-23(42)36(16(3)50-27)52-25-10-9-20(39)15(2)48-25/h6-8,15-17,20,22-27,36-37,39-42,44,46-47H,5,9-14H2,1-4H3/t15-,16-,17-,20-,22-,23-,24-,25-,26-,27-,36+,37+,38-/m0/s1
InChIKeyXGPWWOMGKGUTPY-JSBASDIWSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (29767975)
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)
L-rhodinose-2-deoxy-L-fucose-2-deoxy-L-fucose-10-decarbomethoxy-epsilon-rhodomycinone (CHEBI:209429) is a anthracycline (CHEBI:48120)
IUPAC Name 
(7S,9S)-9-ethyl-4,6,9,11-tetrahydroxy-7-[(2R,4S,5S,6S)-4-hydroxy-5-[(2S,4S,5S,6S)-4-hydroxy-5-[(2S,5S,6S)-5-hydroxy-6-methyloxan-2-yl]oxy-6-methyloxan-2-yl]oxy-6-methyloxan-2-yl]oxy-8,10-dihydro-7H-tetracene-5,12-dione
Manual XrefsDatabases
78439067ChemSpider