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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 > lipid > steroid > 17beta-hydroxy-3-methoxyestra-1,3,5(10)-triene-17-carbonitrile
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic polycyclic compound > steroid > 17beta-hydroxy-3-methoxyestra-1,3,5(10)-triene-17-carbonitrile
... > 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 > steroid > 17beta-hydroxy-3-methoxyestra-1,3,5(10)-triene-17-carbonitrile
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic polycyclic compound > steroid > 17beta-hydroxy-3-methoxyestra-1,3,5(10)-triene-17-carbonitrile
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > polycyclic compound > organic polycyclic compound > steroid > 17beta-hydroxy-3-methoxyestra-1,3,5(10)-triene-17-carbonitrile

Preferred term

17beta-hydroxy-3-methoxyestra-1,3,5(10)-triene-17-carbonitrile  

Type

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

Broader concept

charge

  • 0

formula

  • C20H25NO2

has_parent_hydride

inchi

  • InChI=1S/C20H25NO2/c1-19-9-7-16-15-6-4-14(23-2)11-13(15)3-5-17(16)18(19)8-10-20(19,22)12-21/h4,6,11,16-18,22H,3,5,7-10H2,1-2H3/t16-,17-,18+,19+,20-/m1/s1

inchikey

  • JLKBXDGMZFCRPY-SWBPCFCJSA-N

mass

  • 311.41800

monoisotopicmass

  • 311.18853

smiles

  • COc1ccc2[C@H]3CC[C@@]4(C)[C@@H](CC[C@@]4(O)C#N)[C@@H]3CCc2c1

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:79582

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