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CHEBI:224110 - Validamycin D

ChEBI IDCHEBI:224110
ChEBI NameValidamycin D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H35NO13
Net Charge0
Average Mass497.494
Monoisotopic Mass497.21084
SMILESOCC1=C[C@@H](N[C@@H]2C[C@@H](CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O
InChIInChI=1S/C20H35NO13/c22-3-6-1-8(13(26)16(29)11(6)24)21-9-2-7(12(25)17(30)14(9)27)5-33-20-19(32)18(31)15(28)10(4-23)34-20/h1,7-32H,2-5H2/t7-,8+,9+,10+,11-,12-,13-,14-,15+,16+,17+,18-,19+,20+/m0/s1
InChIKeyDZOSEJASWWCMOA-ORQKAPIHSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (5010646)
ChEBI Ontology
Outgoing Relation(s)
Validamycin D (CHEBI:224110) is a glycoside (CHEBI:24400)
IUPAC Name 
(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[[(1S,2S,3R,4S,5R)-2,3,4-trihydroxy-5-[[(1R,4S,5R,6S)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]amino]cyclohexyl]methoxy]oxane-3,4,5-triol
Manual XrefsDatabases
78443176ChemSpider