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CHEBI:207658 - Chaetomugilin K

ChEBI IDCHEBI:207658
ChEBI NameChaetomugilin K
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SubmitterMetaboLights
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FormulaC23H29ClO5
Net Charge0
Average Mass420.933
Monoisotopic Mass420.17035
SMILESC/C=C(\C)[C@]1(OC)C[C@H]2C3=COC(/C=C/[C@@H](C)[C@@H](C)O)=CC3=C(Cl)C(=O)[C@@]2(C)O1
InChIInChI=1S/C23H29ClO5/c1-7-14(3)23(27-6)11-19-18-12-28-16(9-8-13(2)15(4)25)10-17(18)20(24)21(26)22(19,5)29-23/h7-10,12-13,15,19,25H,11H2,1-6H3/b9-8+,14-7+/t13-,15-,19+,22+,23+/m1/s1
InChIKeyMNARQGUPBCVGOV-SXSABYTNSA-N
Species of MetaboliteComponentSourceComments
Chaetomium globosum (ncbitaxon:38033) - DOI (10.1016/j.tet.2009.06.125)
ChEBI Ontology
Outgoing Relation(s)
Chaetomugilin K (CHEBI:207658) is a ketal (CHEBI:59777)
IUPAC Name 
(6aS,8S,9aS)-8-[(E)-but-2-en-2-yl]-5-chloro-3-[(E,3R,4R)-4-hydroxy-3-methylpent-1-enyl]-8-methoxy-6a-methyl-9,9a-dihydrouro[2,3-h]isochromen-6-one
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27024230ChemSpider