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CHEBI:199810 - Cebulactam A2

ChEBI IDCHEBI:199810
ChEBI NameCebulactam A2
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H23NO5
Net Charge0
Average Mass345.395
Monoisotopic Mass345.15762
SMILESC/C1=C/[C@H](C)C(=O)[C@@H](C)C(=O)Nc2cc(O)cc3c2O[C@@H]1[C@H](C)[C@H]3O
InChIInChI=1S/C19H23NO5/c1-8-5-9(2)17-10(3)16(23)13-6-12(21)7-14(18(13)25-17)20-19(24)11(4)15(8)22/h5-8,10-11,16-17,21,23H,1-4H3,(H,20,24)/b9-5-/t8-,10+,11+,16+,17-/m0/s1
InChIKeySVJWUMRBXYLBIX-PQQQWMJFSA-N
Species of MetaboliteComponentSourceComments
Saccharopolyspora cebuensis (ncbitaxon:418759) - DOI (10.1016/j.tetlet.2008.09.094)
ChEBI Ontology
Outgoing Relation(s)
Cebulactam A2 (CHEBI:199810) is a 1-benzopyran (CHEBI:38443)
IUPAC Name 
(4R,6S,7Z,9R,10R,11R)-11,14-dihydroxy-4,6,8,10-tetramethyl-17-oxa-2-azatricyclo[7.6.2.012,16]heptadeca-1(15),7,12(16),13-tetraene-3,5-dione
Manual XrefsDatabases
27023393ChemSpider