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

Preferred term

pinnatifinoside a  

Type

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

Broader concept

charge

  • 0

formula

  • C21H18O9

inchi

  • InChI=1S/C21H18O9/c22-7-15-18(26)20(27)21(30-15)8-28-14-6-12(25)16-11(24)5-13(29-19(16)17(14)21)9-1-3-10(23)4-2-9/h1-6,15,18,20,22-23,25-27H,7-8H2/t15-,18-,20+,21-/m0/s1

inchikey

  • FOVMHAAPEQFGFL-MEGFKASBSA-N

mass

  • 414.366

monoisotopicmass

  • 414.09508

smiles

  • O1[C@]2([C@H](O)[C@@H](O)[C@@H]1CO)C3=C(OC2)C=C(O)C4=C3OC(=CC4=O)C5=CC=C(O)C=C5

subset

  • 2_STAR

synonym EXACT

  • (3'R,4'R,5'S,9R)-3',4',5-trihydroxy-5'-(hydroxymethyl)-2-(4-hydroxyphenyl)spiro[8H-uro[2,3-h]chromene-9,2'-oxolane]-4-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:176391

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