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CHEBI:220425 - 2,3,8,9-tetrahydrocineromycin B

ChEBI IDCHEBI:220425
ChEBI Name2,3,8,9-tetrahydrocineromycin B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H30O4
Net Charge0
Average Mass298.423
Monoisotopic Mass298.21441
SMILESC[C@@H]1CCC[C@H](C)[C@@H](C)OC(=O)CC[C@](C)(O)/C=C/[C@@H]1O
InChIInChI=1S/C17H30O4/c1-12-6-5-7-13(2)15(18)8-10-17(4,20)11-9-16(19)21-14(12)3/h8,10,12-15,18,20H,5-7,9,11H2,1-4H3/b10-8+/t12-,13+,14+,15-,17+/m0/s1
InChIKeyOKJSCVKMKIRSLR-LAFBQNCYSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (10513843)
ChEBI Ontology
Outgoing Relation(s)
2,3,8,9-tetrahydrocineromycin B (CHEBI:220425) is a macrolide (CHEBI:25106)
IUPAC Name 
(5S,6E,8R,9R,13S,14R)-5,8-dihydroxy-5,9,13,14-tetramethyl-1-oxacyclotetradec-6-en-2-one
Manual XrefsDatabases
8765584ChemSpider