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CHEBI:209397 - L-rhodinose-2-deoxy-L-fucose-L-rhodinose-beta-rhodomycinone

ChEBI IDCHEBI:209397
ChEBI NameL-rhodinose-2-deoxy-L-fucose-L-rhodinose-beta-rhodomycinone
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC38H48O15
Net Charge0
Average Mass744.787
Monoisotopic Mass744.29932
SMILESCC[C@@]1(O)C[C@H](O[C@H]2CC[C@H](O[C@H]3C[C@H](O)[C@H](O[C@H]4CC[C@H](O)[C@H](C)O4)[C@H](C)O3)[C@H](C)O2)c2c(O)c3c(c(O)c2[C@H]1O)C(=O)c1cccc(O)c1C3=O
InChIInChI=1S/C38H48O15/c1-5-38(47)14-23(28-31(37(38)46)35(45)29-30(34(28)44)33(43)27-18(32(29)42)7-6-8-20(27)40)52-24-12-10-22(16(3)49-24)51-26-13-21(41)36(17(4)50-26)53-25-11-9-19(39)15(2)48-25/h6-8,15-17,19,21-26,36-37,39-41,44-47H,5,9-14H2,1-4H3/t15-,16-,17-,19-,21-,22-,23-,24-,25-,26-,36+,37+,38+/m0/s1
InChIKeyANWPSEWFAIZLJN-OFZISRACSA-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-L-rhodinose-beta-rhodomycinone (CHEBI:209397) is a anthracycline (CHEBI:48120)
IUPAC Name 
(7S,9R,10R)-9-ethyl-4,6,9,10,11-pentahydroxy-7-[(2R,5S,6S)-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
78439062ChemSpider