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Concept information

... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > phenols > 3beta,12-dihydroxy-13-methyl-5,8,11,13-podocarpatetraene-7-one
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > phenols > 3beta,12-dihydroxy-13-methyl-5,8,11,13-podocarpatetraene-7-one
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > phenols > 3beta,12-dihydroxy-13-methyl-5,8,11,13-podocarpatetraene-7-one
... > organooxygen compound > carbonyl compound > ketone > alpha,beta-unsaturated ketone > enone > 3beta,12-dihydroxy-13-methyl-5,8,11,13-podocarpatetraene-7-one
organooxygen compound > carbonyl compound > ketone > aromatic ketone > 3beta,12-dihydroxy-13-methyl-5,8,11,13-podocarpatetraene-7-one
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > aromatic ketone > 3beta,12-dihydroxy-13-methyl-5,8,11,13-podocarpatetraene-7-one

Preferred term

3beta,12-dihydroxy-13-methyl-5,8,11,13-podocarpatetraene-7-one  

Type

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

charge

  • 0

formula

  • C18H22O3

inchi

  • InChI=1S/C18H22O3/c1-10-7-11-12(8-13(10)19)18(4)6-5-16(21)17(2,3)15(18)9-14(11)20/h7-9,16,19,21H,5-6H2,1-4H3/t16-,18+/m0/s1

inchikey

  • XKTPGZPMUGPQQP-FUHWJXTLSA-N

mass

  • 286.36550

monoisotopicmass

  • 286.15689

smiles

  • Cc1cc2C(=O)C=C3C(C)(C)[C@@H](O)CC[C@]3(C)c2cc1O

subset

  • 3_STAR

synonym EXACT

  • (3beta)-3,12-dihydroxy-13-methylpodocarpa-5,8,11,13-tetraen-7-one

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:65781

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