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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 > alcohol > secondary alcohol > 1beta-hydroxybrabetaicicene q
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > alcohol > secondary alcohol > 1beta-hydroxybrabetaicicene q

Preferred term

1beta-hydroxybrabetaicicene q  

Type

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

Broader concept

charge

  • 0

formula

  • C19H28O3

inchi

  • InChI=1S/C19H28O3/c1-10(2)12-7-8-19(4)14(12)9-16(21)11(3)13-5-6-15(20)17(13)18(19)22/h10-11,16,18,21-22H,5-9H2,1-4H3/t11-,16+,18+,19+/m1/s1

inchikey

  • FDSGHSRYDXQBCB-NDLHMUQXSA-N

mass

  • 304.430

monoisotopicmass

  • 304.20384

smiles

  • O=C1C2=C([C@H]([C@@H](O)CC=3[C@@]([C@H]2O)(CCC3C(C)C)C)C)CC1

subset

  • 2_STAR

synonym EXACT

  • (1S,2R,8R,9S)-2,9-dihydroxy-1,8-dimethyl-12-propan-2-yltricyclo[9.3.0.03,7]tetradeca-3(7),11-dien-4-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:226652

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