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Chemistry, part 2

Content language

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Concept information

... > organooxygen compound > carbonyl compound > ketone > cyclic ketone > alicyclic ketone > cyclohexenones > difurebin b
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic oxo compound > carbonyl compound > ketone > cyclic ketone > alicyclic ketone > cyclohexenones > difurebin b
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > cyclic ketone > alicyclic ketone > cyclohexenones > difurebin b

Preferred term

difurebin b  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C18H20O6

inchi

  • InChI=1S/C18H20O6/c1-7-9(3)15(5)13(21)17(23,11(7)19)16(6)10(4)8(2)12(20)18(15,24)14(16)22/h23-24H,1-6H3/t15-,16+,17-,18+

inchikey

  • XAUDMBFOZPLRIC-USTZCAOPSA-N

mass

  • 332.352

monoisotopicmass

  • 332.12599

smiles

  • O=C1C(=C([C@]2([C@]3(O)C(=O)C(=C([C@]([C@]1(O)C2=O)(C3=O)C)C)C)C)C)C

subset

  • 2_STAR

synonym EXACT

  • (1R,2R,6S,7S)-2,7-dihydroxy-1,4,5,6,9,10-hexamethyltricyclo[5.3.1.12,6]dodeca-4,9-diene-3,8,11,12-tetrone

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:208639

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