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CHEBI:202827 - Saquayamycin G

ChEBI IDCHEBI:202827
ChEBI NameSaquayamycin G
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC37H42O14
Net Charge0
Average Mass710.729
Monoisotopic Mass710.25746
SMILESC[C@@H]1O[C@@H](O[C@H]2CC[C@H](O[C@@]3(C)CC(=O)[C@]4(O)C5=C(C=C[C@]4(O)C3)C(=O)c3c(ccc([C@H]4C[C@@H](O)[C@H](O)[C@@H](C)O4)c3O)C5=O)O[C@H]2C)C=CC1=O
InChIInChI=1S/C37H42O14/c1-16-22(38)7-9-27(48-16)50-24-8-10-28(49-17(24)2)51-35(4)14-26(40)37(46)30-21(11-12-36(37,45)15-35)33(43)29-20(34(30)44)6-5-19(32(29)42)25-13-23(39)31(41)18(3)47-25/h5-7,9,11-12,16-18,23-25,27-28,31,39,41-42,45-46H,8,10,13-15H2,1-4H3/t16-,17-,18+,23+,24-,25+,27-,28-,31+,35-,36-,37-/m0/s1
InChIKeyRKJBESAIGDWQII-UKRVPBRBSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (22758660)
Roles Classification
Biological Role:
bacterial metabolite  Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
ChEBI Ontology
Outgoing Relation(s)
Saquayamycin G (CHEBI:202827) is a angucycline (CHEBI:48130)
IUPAC Name 
(3R,4aR,12bS)-9-[(2R,4R,5S,6R)-4,5-dihydroxy-6-methyloxan-2-yl]-4a,8,12b-trihydroxy-3-methyl-3-[(2S,5S,6S)-6-methyl-5-[[(2R,6S)-6-methyl-5-oxo-2H-pyran-2-yl]oxy]oxan-2-yl]oxy-2,4-dihydrobenzo[a]anthracene-1,7,12-trione
Manual XrefsDatabases
28512162ChemSpider