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CHEBI:215066 - (+/-)-hemi-oxanthromicin D

ChEBI IDCHEBI:215066
ChEBI Name(+/-)-hemi-oxanthromicin D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H26O9
Net Charge0
Average Mass446.452
Monoisotopic Mass446.15768
SMILESCc1ccc2c(c1O)C(=O)c1c(C)cc(O[C@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)cc1C2(C)O
InChIInChI=1S/C23H26O9/c1-9-4-5-12-16(17(9)25)19(27)15-10(2)6-11(7-13(15)23(12,3)30)31-22-21(29)20(28)18(26)14(8-24)32-22/h4-7,14,18,20-22,24-26,28-30H,8H2,1-3H3/t14-,18+,20+,21-,22+,23?/m1/s1
InChIKeyKCAFPCYZUAFXHS-BJJGDXLVSA-N
Species of MetaboliteComponentSourceComments
Actinomadura (ncbitaxon:1988) - DOI (10.1016/j.phytol.2018.04.002)
ChEBI Ontology
Outgoing Relation(s)
(+/-)-hemi-oxanthromicin D (CHEBI:215066) is a glycoside (CHEBI:24400)
IUPAC Name 
1,10-dihydroxy-2,8,10-trimethyl-6-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyanthracen-9-one