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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 > flavonoids > flavonoid > flavones > semiglabrinol
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > flavonoids > flavonoid > anthoxanthin > flavones > semiglabrinol

Preferred term

semiglabrinol  

Type

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

Broader concept

charge

  • 0

formula

  • C21H18O5

inchi

  • InChI=1S/C21H18O5/c1-21(2)19(23)17-16-14(25-20(17)26-21)9-8-12-13(22)10-15(24-18(12)16)11-6-4-3-5-7-11/h3-10,17,19-20,23H,1-2H3/t17-,19-,20+/m1/s1

inchikey

  • XBKLVCYSINXGAW-RLLQIKCJSA-N

mass

  • 350.370

monoisotopicmass

  • 350.11542

smiles

  • O1C([C@H](O)[C@@]2([C@]1(OC3=C2C=4OC(=CC(=O)C4C=C3)C5=CC=CC=C5)[H])[H])(C)C

subset

  • 2_STAR

synonym EXACT

  • (12S,15R,16R)-15-hydroxy-14,14-dimethyl-4-phenyl-3,11,13-trioxatetracyclo[8.6.0.02,7.012,16]hexadeca-1(10),2(7),4,8-tetraen-6-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:188973

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