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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 > guignardone i
... > 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 > guignardone i
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > cyclic ketone > alicyclic ketone > cyclohexenones > guignardone i

Preferred term

guignardone i  

Type

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

Broader concept

charge

  • 0

formula

  • C17H26O5

inchi

  • InChI=1S/C17H26O5/c1-16(2,20)10-5-6-17(3)11(10)7-9-14(19)13(21-4)8-12(18)15(9)22-17/h10-13,18,20H,5-8H2,1-4H3/t10-,11+,12+,13+,17-/m1/s1

inchikey

  • WRBUZDRDVYGZFV-KEKQHROYSA-N

mass

  • 310.390

monoisotopicmass

  • 310.17802

smiles

  • O=C1C2=C(O[C@@]3(CC[C@H]([C@@H]3C2)C(O)(C)C)C)[C@@H](O)C[C@@H]1OC

subset

  • 2_STAR

synonym EXACT

  • (1R,3aR,5S,7S,9aS)-5-hydroxy-1-(2-hydroxypropan-2-yl)-7-methoxy-3a-methyl-1,2,3,5,6,7,9,9a-octahydrocyclopenta[b]chromen-8-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:200862

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