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Concept information

... > organooxygen compound > carbonyl compound > ketone > cyclic ketone > alicyclic ketone > cyclohexenones > 4,4a,5,6,7-hexahydro-3-hydroxy-6-(1',2'-dihydroxy-1'-methylethyl)-4-methyl-2(3h)-naphthalenone
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > cyclic ketone > alicyclic ketone > cyclohexenones > 4,4a,5,6,7-hexahydro-3-hydroxy-6-(1',2'-dihydroxy-1'-methylethyl)-4-methyl-2(3h)-naphthalenone

Preferred term

4,4a,5,6,7-hexahydro-3-hydroxy-6-(1',2'-dihydroxy-1'-methylethyl)-4-methyl-2(3h)-naphthalenone  

Type

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

Broader concept

charge

  • 0

formula

  • C14H22O4

inchi

  • InChI=1S/C14H22O4/c1-8-11-6-10(14(2,18)7-15)4-3-9(11)5-12(16)13(8)17/h5,8,10-11,13,15,17-18H,3-4,6-7H2,1-2H3

inchikey

  • YARSTGAEKZQRNL-UHFFFAOYSA-N

mass

  • 254.326

monoisotopicmass

  • 254.15181

smiles

  • O=C1C=C2C(CC(C(O)(CO)C)CC2)C(C1O)C

subset

  • 2_STAR

synonym EXACT

  • 6-(1,2-dihydroxypropan-2-yl)-3-hydroxy-4-methyl-4,4a,5,6,7,8-hexahydro-3H-naphthalen-2-one

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:203391

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