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CHEBI:223186 - Sulfurmycin D

ChEBI IDCHEBI:223186
ChEBI NameSulfurmycin D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC31H35NO11
Net Charge0
Average Mass597.617
Monoisotopic Mass597.22101
SMILESCOC(=O)[C@@H]1c2cc3c(c(O)c2[C@@H](O[C@H]2C[C@H](N(C)C)[C@H](O)[C@@H](C)O2)C[C@@]1(O)CC(C)=O)C(=O)c1c(O)cccc1C3=O
InChIInChI=1S/C31H35NO11/c1-13(33)11-31(40)12-20(43-21-10-18(32(3)4)26(35)14(2)42-21)23-16(25(31)30(39)41-5)9-17-24(29(23)38)28(37)22-15(27(17)36)7-6-8-19(22)34/h6-9,14,18,20-21,25-26,34-35,38,40H,10-12H2,1-5H3/t14-,18+,20+,21+,25+,26-,31+/m1/s1
InChIKeyYPHXBUMJGHZUMJ-IQPZYDOFSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (7186414)
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)
Sulfurmycin D (CHEBI:223186) is a anthracycline (CHEBI:48120)
IUPAC Name 
methyl (1R,2R,4S)-4-[(2R,4S,5S,6R)-4-(dimethylamino)-5-hydroxy-6-methyloxan-2-yl]oxy-2,5,7-trihydroxy-6,11-dioxo-2-(2-oxopropyl)-3,4-dihydro-1H-tetracene-1-carboxylate
Manual XrefsDatabases
78443066ChemSpider