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CHEBI:216073 - 8,13-deoxynodusmicin

ChEBI IDCHEBI:216073
ChEBI Name8,13-deoxynodusmicin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H36O6
Net Charge0
Average Mass408.535
Monoisotopic Mass408.25119
SMILESCO[C@H]1C[C@H]2C=C[C@H]3C[C@H](O)[C@H](C)[C@@H](O)[C@H]3C2/C(C)=C/[C@@H](C)[C@@H]([C@@H](C)O)OC1=O
InChIInChI=1S/C23H36O6/c1-11-8-12(2)22(14(4)24)29-23(27)18(28-5)10-16-7-6-15-9-17(25)13(3)21(26)20(15)19(11)16/h6-8,12-22,24-26H,9-10H2,1-5H3/b11-8+/t12-,13+,14-,15+,16-,17+,18+,19?,20-,21-,22+/m1/s1
InChIKeyXBKJTHNPVQIEIV-FKFKYKLWSA-N
Species of MetaboliteComponentSourceComments
Nocardiaspecies CS682 (ncbitaxon:1047172) - PubMed (32208643)
ChEBI Ontology
Outgoing Relation(s)
8,13-deoxynodusmicin (CHEBI:216073) is a oxacycle (CHEBI:38104)
IUPAC Name 
(2R,3S,4S,5S,7R,10S,12S,15S,16R,17E)-3,5-dihydroxy-15-[(1R)-1-hydroxyethyl]-12-methoxy-4,16,18-trimethyl-14-oxatricyclo[8.8.0.02,7]octadeca-8,17-dien-13-one