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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 > organic hydroxy compound > alcohol > tertiary alcohol > alterbrasone
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > alcohol > tertiary alcohol > alterbrasone

Preferred term

alterbrasone  

Type

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

Broader concept

charge

  • 0

formula

  • C14H18O3

inchi

  • InChI=1S/C14H18O3/c1-5-7-10-12(11(15)8-6-2)14(4,17)9(3)13(10)16/h5-9,17H,1-4H3/b7-5+,8-6+/t9-,14-/m1/s1

inchikey

  • DWFPYAPCVLPCFN-IGRPCBJSSA-N

mass

  • 234.295

monoisotopicmass

  • 234.12559

smiles

  • O=C1C(=C(C(=O)/C=C/C)[C@@]([C@@H]1C)(O)C)/C=C/C

subset

  • 2_STAR

synonym EXACT

  • (4R,5S)-3-[(E)-but-2-enoyl]-4-hydroxy-4,5-dimethyl-2-[(E)-prop-1-enyl]cyclopent-2-en-1-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:220038

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