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Chemistry, part 1

Content language

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Concept information

... > chemical entity > molecular entity > ion > cation > organic cation > (3r)-7,2'-dihydroxy-4'-methoxyisoflavanol 4-oxonium cation
... > chemical entity > molecular entity > ion > organic ion > organic cation > (3r)-7,2'-dihydroxy-4'-methoxyisoflavanol 4-oxonium cation
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic ion > organic cation > (3r)-7,2'-dihydroxy-4'-methoxyisoflavanol 4-oxonium cation

Preferred term

(3r)-7,2'-dihydroxy-4'-methoxyisoflavanol 4-oxonium cation  

Type

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

Broader concept

charge

  • +1

formula

  • C16H17O5

inchi

  • InChI=1S/C16H16O5/c1-20-10-3-5-11(14(18)7-10)13-8-21-15-6-9(17)2-4-12(15)16(13)19/h2-7,13,16-19H,8H2,1H3/p+1/t13-,16?/m0/s1

inchikey

  • YZBBUYKPTHDZHF-KNVGNIICSA-O

is_conjugate_acid_of

mass

  • 289.30320

monoisotopicmass

  • 289.10705

smiles

  • COc1ccc([C@@H]2COc3cc(O)ccc3C2[OH2+])c(O)c1

subset

  • 3_STAR

synonym EXACT

  • [(3R)-7-hydroxy-3-(2-hydroxy-4-methoxyphenyl)-3,4-dihydro-2H-chromen-4-yl]oxonium

synonym RELATED

  • 7,2'-dihydroxy-4'-methoxy-isoflavanol carbocation intermediate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:72648

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