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Chemistry, part 2

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic hydroxy compound > beta-hydroxy ketone > peaurantiogriseol d
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > beta-hydroxy ketone > peaurantiogriseol d
organooxygen compound > carbonyl compound > ketone > beta-hydroxy ketone > peaurantiogriseol d
... > 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 > beta-hydroxy ketone > peaurantiogriseol d
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > beta-hydroxy ketone > peaurantiogriseol d

Preferred term

peaurantiogriseol d  

Type

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

Broader concept

charge

  • 0

formula

  • C16H26O4

inchi

  • InChI=1S/C16H26O4/c1-14(19)7-5-12-11(10-14)4-8-15(2,20)16(12,3)13(18)6-9-17/h4,8,11-12,17,19-20H,5-7,9-10H2,1-3H3/t11-,12-,14-,15+,16-/m0/s1

inchikey

  • LWCQKJINOCQTMW-AMSCCUFHSA-N

mass

  • 282.380

monoisotopicmass

  • 282.18311

smiles

  • O=C([C@]1([C@](O)(C=C[C@@H]2[C@@H]1CC[C@@](C2)(O)C)C)C)CCO

subset

  • 2_STAR

synonym EXACT

  • 1-[(1R,2R,4aR,6S,8aS)-2,6-dihydroxy-1,2,6-trimethyl-5,7,8,8a-tetrahydro-4aH-naphthalen-1-yl]-3-hydroxypropan-1-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:220040

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