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CHEBI:220879 - UCS1025A

ChEBI IDCHEBI:220879
ChEBI NameUCS1025A
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SubmitterMetaboLights
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FormulaC20H25NO5
Net Charge0
Average Mass359.422
Monoisotopic Mass359.17327
SMILESC[C@H]1C=C[C@H]2CCCC[C@@H]2[C@H]1C(=O)[C@@H]1C(=O)N2CC[C@H]3C(=O)O[C@@H]1[C@]32O
InChIInChI=1S/C20H25NO5/c1-10-6-7-11-4-2-3-5-12(11)14(10)16(22)15-17-20(25)13(19(24)26-17)8-9-21(20)18(15)23/h6-7,10-15,17,25H,2-5,8-9H2,1H3/t10-,11+,12-,13-,14-,15-,17-,20+/m0/s1
InChIKeyVUQSZZXQGQSRJA-TWKBTRLKSA-N
Species of MetaboliteComponentSourceComments
Acremonium (ncbitaxon:159075) - PubMed (10819301)
ChEBI Ontology
Outgoing Relation(s)
UCS1025A (CHEBI:220879) is a cyclic ketone (CHEBI:3992)
UCS1025A (CHEBI:220879) is a organic heterobicyclic compound (CHEBI:27171)
UCS1025A (CHEBI:220879) is a organonitrogen heterocyclic compound (CHEBI:38101)
IUPAC Name 
(3R,4S,7R,10R)-3-[(1S,2S,4aR,8aS)-2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalene-1-carbonyl]-10-hydroxy-5-oxa-1-azatricyclo[5.2.1.04,10]decane-2,6-dione
Manual XrefsDatabases
9884922ChemSpider