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CHEBI:200105 - Arcticoside

ChEBI IDCHEBI:200105
ChEBI NameArcticoside
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SubmitterMetaboLights
DownloadsMolfile
FormulaC23H29NO15
Net Charge0
Average Mass559.477
Monoisotopic Mass559.15372
SMILESC=C1Oc2cc(OC)cc(C(=O)OC[C@H]3O[C@H](OC[C@H]4O[C@H](O)[C@H](O)[C@@H](O)[C@@H]4O)[C@H](O)[C@@H](O)[C@@H]3O)c2NC1=O
InChIInChI=1S/C23H29NO15/c1-7-20(31)24-13-9(3-8(34-2)4-10(13)37-7)21(32)35-5-12-15(26)17(28)19(30)23(39-12)36-6-11-14(25)16(27)18(29)22(33)38-11/h3-4,11-12,14-19,22-23,25-30,33H,1,5-6H2,2H3,(H,24,31)/t11-,12-,14-,15-,16+,17+,18-,19-,22+,23+/m1/s1
InChIKeyISCDDVAKOLFDON-IANVEIBGSA-N
Species of MetaboliteComponentSourceComments
Streptomycesspecies (ncbitaxon:1931) - PubMed (24796308)
ChEBI Ontology
Outgoing Relation(s)
Arcticoside (CHEBI:200105) is a benzoxazine (CHEBI:46969)
IUPAC Name 
[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6S)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-2-yl]methyl 7-methoxy-2-methylidene-3-oxo-4H-1,4-benzoxazine-5-carboxylate
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32675065ChemSpider