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CHEBI:181081 - Chloroaustralasine B

ChEBI IDCHEBI:181081
ChEBI NameChloroaustralasine B
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SubmitterMetaboLights
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FormulaC19H22ClNO3
Net Charge0
Average Mass347.842
Monoisotopic Mass347.12882
SMILES[H][C@@]12c3c(c4ccccc4nc3=O)OC(C)(C)[C@@]1([H])CC[C@@](C)(O)[C@@H]2Cl
InChIInChI=1S/C19H22ClNO3/c1-18(2)11-8-9-19(3,23)16(20)13(11)14-15(24-18)10-6-4-5-7-12(10)21-17(14)22/h4-7,11,13,16,23H,8-9H2,1-3H3,(H,21,22)/t11-,13-,16+,19+/m0/s1
InChIKeyYMYIMKIYRMUBDY-LDHJFUFUSA-N
ChEBI Ontology
Outgoing Relation(s)
Chloroaustralasine B (CHEBI:181081) is a organic heterotricyclic compound (CHEBI:26979)
Chloroaustralasine B (CHEBI:181081) is a organonitrogen heterocyclic compound (CHEBI:38101)
Chloroaustralasine B (CHEBI:181081) is a oxacycle (CHEBI:38104)
IUPAC Name 
(6aS,9R,10R,10aS)-10-chloro-9-hydroxy-6,6,9-trimethyl-6a,7,8,10,10a,12-hexahydroisochromeno[4,3-c]quinolin-11-one