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CHEBI:44275 - U-58872, HYDROXY DERIVATIVE OF NOGALAMYCIN

Default Structure
ChEBI IDCHEBI:44275
ChEBI NameU-58872, HYDROXY DERIVATIVE OF NOGALAMYCIN
Stars
DownloadsMolfile
FormulaC39H49NO17
Net Charge0
Average Mass803.811
Monoisotopic Mass803.30005
SMILES[H]Oc1c([H])c2c(c3c1C(=O)c1c(O[H])c4c(c([H])c1C3=O)[C@@]([H])(C(=O)OC([H])([H])[H])[C@](O[H])(C([H])([H])[H])C([H])([H])[C@]4([H])O[C@]1([H])O[C@@]([H])(C([H])([H])[H])[C@]([H])(OC([H])([H])[H])[C@](OC([H])([H])[H])(C([H])([H])[H])[C@@]1([H])OC([H])([H])[H])O[C@]1([H])O[C@@]2(C([H])([H])[H])[C@]([H])(O[H])[C@@]([H])(N(C([H])([H])[H])C([H])([H])O[H])[C@]1([H])O[H]
InChIInChI=1S/C39H49NO17/c1-14-32(50-6)39(4,53-9)33(51-7)36(54-14)55-19-12-37(2,49)24(34(48)52-8)15-10-16-21(27(44)20(15)19)28(45)22-18(42)11-17-30(23(22)26(16)43)56-35-29(46)25(40(5)13-41)31(47)38(17,3)57-35/h10-11,14,19,24-25,29,31-33,35-36,41-42,44,46-47,49H,12-13H2,1-9H3/t14-,19-,24-,25-,29-,31+,32-,33-,35+,36-,37-,38+,39+/m0/s1
InChIKeyLZNCBRPUGPTNSO-JYOBTZKQSA-N
ChEBI Ontology
Outgoing Relation(s)
U-58872, HYDROXY DERIVATIVE OF NOGALAMYCIN (CHEBI:44275) is a unclassifieds (CHEBI:27189)
Synonyms  Source
methyl (2R,3S,4R,5R,6R,11S,13S,14R)-11-[(6-deoxy-3-C-methyl-2,3,4-tri-O-methyl-alpha-L-mannopyranosyl)oxy]-3,5,8,10,13-pentahydroxy-4-[(hydroxymethyl)(methyl)amino]-6,13-dimethyl-9,16-dioxo-3,4,5,6,9,11,12,13,14,16-decahydro-2H-2,6-epoxytetraceno[1,2-b]oxocine-14-carboxylatePDBeChem
U-58872, HYDROXY DERIVATIVE OF NOGALAMYCINPDBeChem
Manual XrefsDatabases
NGUPDBeChem