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CHEBI:222397 - Validamycin G

ChEBI IDCHEBI:222397
ChEBI NameValidamycin G
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SubmitterMetaboLights
DownloadsMolfile
FormulaC20H35NO14
Net Charge0
Average Mass513.493
Monoisotopic Mass513.20575
SMILESOCC1=C[C@@H](N[C@@H]2C[C@@](O)(CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@@H]1O
InChIInChI=1S/C20H35NO14/c22-3-6-1-7(11(26)14(29)10(6)25)21-8-2-20(33,5-24)18(16(31)12(8)27)35-19-17(32)15(30)13(28)9(4-23)34-19/h1,7-19,21-33H,2-5H2/t7-,8-,9-,10-,11+,12-,13-,14-,15+,16-,17-,18+,19+,20-/m1/s1
InChIKeyFKVLATUQODRNIC-HMNWHVMUSA-N
Species of MetaboliteComponentSourceComments
Streptomyces hygroscopicus subsp. limoneus (ncbitaxon:264445) - PubMed (3536829)
ChEBI Ontology
Outgoing Relation(s)
Validamycin G (CHEBI:222397) is a glycoside (CHEBI:24400)
IUPAC Name 
(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[(1S,2R,4R,5R,6R)-2,5,6-trihydroxy-2-(hydroxymethyl)-4-[[(1R,4R,5R,6S)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]amino]cyclohexyl]oxyoxane-3,4,5-triol
Manual XrefsDatabases
78443006ChemSpider