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Concept information

... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > phenols > (-)-(4s,5s,10r)-10,12,18-trihydroxy-7-oxo-20-norabieta-8,11,13-triene
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > phenols > (-)-(4s,5s,10r)-10,12,18-trihydroxy-7-oxo-20-norabieta-8,11,13-triene
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > phenols > (-)-(4s,5s,10r)-10,12,18-trihydroxy-7-oxo-20-norabieta-8,11,13-triene
... > organooxygen compound > carbonyl compound > ketone > cyclic ketone > alicyclic ketone > cyclic terpene ketone > (-)-(4s,5s,10r)-10,12,18-trihydroxy-7-oxo-20-norabieta-8,11,13-triene
... > organooxygen compound > carbonyl compound > ketone > terpene ketone > cyclic terpene ketone > (-)-(4s,5s,10r)-10,12,18-trihydroxy-7-oxo-20-norabieta-8,11,13-triene
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > terpene ketone > cyclic terpene ketone > (-)-(4s,5s,10r)-10,12,18-trihydroxy-7-oxo-20-norabieta-8,11,13-triene

Preferred term

(-)-(4s,5s,10r)-10,12,18-trihydroxy-7-oxo-20-norabieta-8,11,13-triene  

Type

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

charge

  • 0

formula

  • C19H26O4

inchi

  • InChI=1S/C19H26O4/c1-11(2)12-7-13-14(8-15(12)21)19(23)6-4-5-18(3,10-20)17(19)9-16(13)22/h7-8,11,17,20-21,23H,4-6,9-10H2,1-3H3/t17-,18+,19-/m0/s1

inchikey

  • RDRFKMSTCAZPEC-OTWHNJEPSA-N

mass

  • 318.40730

monoisotopicmass

  • 318.18311

smiles

  • CC(C)c1cc2C(=O)C[C@H]3[C@@](C)(CO)CCC[C@]3(O)c2cc1O

subset

  • 3_STAR

synonym EXACT

  • (1S,4aR,10aS)-4a,6-dihydroxy-1-(hydroxymethyl)-1-methyl-7-(propan-2-yl)-2,3,4,4a,10,10a-hexahydrophenanthren-9(1H)-one

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:70568

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