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CHEBI:218186 - Chaetothyrin A

ChEBI IDCHEBI:218186
ChEBI NameChaetothyrin A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC16H24O4
Net Charge0
Average Mass280.364
Monoisotopic Mass280.16746
SMILESCOC1=C2C(=O)OC[C@@H]2[C@@]2(C)CCCC(C)(C)[C@@H]2[C@H]1O
InChIInChI=1S/C16H24O4/c1-15(2)6-5-7-16(3)9-8-20-14(18)10(9)12(19-4)11(17)13(15)16/h9,11,13,17H,5-8H2,1-4H3/t9-,11-,13-,16+/m0/s1
InChIKeyHNMFXTFSDXGPBX-DFGBYOQWSA-N
ChEBI Ontology
Outgoing Relation(s)
Chaetothyrin A (CHEBI:218186) is a naphthofuran (CHEBI:39270)
IUPAC Name 
(5R,5aS,9aR,9bR)-5-hydroxy-4-methoxy-6,6,9a-trimethyl-5,5a,7,8,9,9b-hexahydro-1H-benzo[e][2]benzouran-3-one
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78441793ChemSpider