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Chemistry, part 2

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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 > polyol > triol > (+)-phytocassane b
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > polyol > triol > (+)-phytocassane b
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic hydroxy compound > alcohol > secondary alcohol > phytocassane > (+)-phytocassane b
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > alcohol > secondary alcohol > phytocassane > (+)-phytocassane b
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > olefinic compound > enone > phytocassane > (+)-phytocassane b
... > organooxygen compound > carbonyl compound > ketone > alpha,beta-unsaturated ketone > enone > phytocassane > (+)-phytocassane b
... > 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 > alpha,beta-unsaturated ketone > enone > phytocassane > (+)-phytocassane b
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > alpha,beta-unsaturated ketone > enone > phytocassane > (+)-phytocassane b
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic polycyclic compound > organic tricyclic compound > tricyclic diterpenoid > phytocassane > (+)-phytocassane b
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic polycyclic compound > organic tricyclic compound > tricyclic diterpenoid > phytocassane > (+)-phytocassane b
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic polycyclic compound > organic tricyclic compound > tricyclic diterpenoid > phytocassane > (+)-phytocassane b
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > polycyclic compound > organic polycyclic compound > organic tricyclic compound > tricyclic diterpenoid > phytocassane > (+)-phytocassane b
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > isoprenoid > terpenoid > diterpenoid > tricyclic diterpenoid > phytocassane > (+)-phytocassane b
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > diterpenoid > tricyclic diterpenoid > phytocassane > (+)-phytocassane b

Preferred term

(+)-phytocassane b  

Type

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

Broader concept

charge

  • 0

formula

  • C20H30O4

inchi

  • InChI=1S/C20H30O4/c1-6-11-9-13(21)15-12(10(11)2)7-8-14-19(3,4)17(23)16(22)18(24)20(14,15)5/h6,9-10,12,14-18,22-24H,1,7-8H2,2-5H3/t10-,12-,14-,15+,16+,17-,18+,20-/m1/s1

inchikey

  • XFRCVLKGZMPUFQ-SUIMNPQMSA-N

mass

  • 334.451

monoisotopicmass

  • 334.21441

smiles

  • [C@@H]1([C@H]([C@H](C([C@]2([H])[C@]1(C)[C@@]3(C(C=C([C@H]([C@]3(CC2)[H])C)C=C)=O)[H])(C)C)O)O)O

subset

  • 3_STAR

synonym EXACT

  • 1alpha,2alpha,3alpha-trihydroxy-14beta-methyl-13-vinyl-5beta,8alpha,9beta,10alpha,14beta-podocarp-12-en-11-one

synonym RELATED

  • (1alpha,2alpha,3alpha,5beta,8alpha,9beta,10alpha,14beta)-1,2,3-trihydroxy-14-methyl-13-vinylpodocarp-12-en-11-one
  • (1S,4aR,4bR,5R,6S,7S,8aR,10aR)-2-ethenyl-5,6,7-trihydroxy-1,4b,8,8-tetramethyl-4a,4b,5,6,7,8,8a,9,10,10a-decahydrophenanthren-4(1H)-one
  • (1S,4aR,4bR,5R,6S,7S,8aR,10aR)-5,6,7-trihydroxy-1,4b,8,8-tetramethyl-2-vinyl-4a,4b,5,6,7,8,8a,9,10,10a-decahydrophenanthren-4(1H)-one
  • phytocassane B

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:72666

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