CHEBI:138817 - Kylinone

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ChEBI Name Kylinone
ChEBI ID CHEBI:138817
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C15H21Br2ClO
Net Charge 0
Average Mass 412.587
Monoisotopic Mass 409.96477
InChI InChI=1S/C15H21Br2ClO/c1-9-7-10(16)13(2,3)15(12(9)19)6-5-14(4,18)11(17)8-15/h7,9,11H,5-6,8H2,1-4H3/t9-,11-,14-,15-/m0/s1
InChIKey HMWLZIQJSYGFHO-YIVQXAGMSA-N
SMILES [C@H]1([C@@](CC[C@]2(C1)C([C@H](C=C(C2(C)C)Br)C)=O)(C)Cl)Br
ChEBI Ontology
Outgoing Kylinone (CHEBI:138817) is a cyclohexenones (CHEBI:48953)
Manual Xref Database
10266595 ChemSpider
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Last Modified
25 October 2017