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Chemistry, part 2

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Concept information

... > organooxygen compound > carbonyl compound > ketone > cyclic ketone > isoflavones > 4-hydroxy-5-(dihydroxyphenyl)-valeric acid-o-methyl-o-sulphate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic oxo compound > carbonyl compound > ketone > cyclic ketone > isoflavones > 4-hydroxy-5-(dihydroxyphenyl)-valeric acid-o-methyl-o-sulphate
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > cyclic ketone > isoflavones > 4-hydroxy-5-(dihydroxyphenyl)-valeric acid-o-methyl-o-sulphate
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > phenylpropanoid > isoflavonoid > isoflavones > 4-hydroxy-5-(dihydroxyphenyl)-valeric acid-o-methyl-o-sulphate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic aromatic compound > phenylpropanoid > isoflavonoid > isoflavones > 4-hydroxy-5-(dihydroxyphenyl)-valeric acid-o-methyl-o-sulphate
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > phenylpropanoid > isoflavonoid > isoflavones > 4-hydroxy-5-(dihydroxyphenyl)-valeric acid-o-methyl-o-sulphate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > flavonoids > isoflavonoid > isoflavones > 4-hydroxy-5-(dihydroxyphenyl)-valeric acid-o-methyl-o-sulphate
... > organooxygen compound > oxacycle > benzopyran > 1-benzopyran > isoflavonoid > isoflavones > 4-hydroxy-5-(dihydroxyphenyl)-valeric acid-o-methyl-o-sulphate
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > benzopyran > 1-benzopyran > isoflavonoid > isoflavones > 4-hydroxy-5-(dihydroxyphenyl)-valeric acid-o-methyl-o-sulphate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > benzopyran > 1-benzopyran > isoflavonoid > isoflavones > 4-hydroxy-5-(dihydroxyphenyl)-valeric acid-o-methyl-o-sulphate
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > benzopyran > 1-benzopyran > isoflavonoid > isoflavones > 4-hydroxy-5-(dihydroxyphenyl)-valeric acid-o-methyl-o-sulphate
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > benzopyran > 1-benzopyran > isoflavonoid > isoflavones > 4-hydroxy-5-(dihydroxyphenyl)-valeric acid-o-methyl-o-sulphate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > benzopyran > 1-benzopyran > isoflavonoid > isoflavones > 4-hydroxy-5-(dihydroxyphenyl)-valeric acid-o-methyl-o-sulphate
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > benzopyran > 1-benzopyran > isoflavonoid > isoflavones > 4-hydroxy-5-(dihydroxyphenyl)-valeric acid-o-methyl-o-sulphate

Preferred term

4-hydroxy-5-(dihydroxyphenyl)-valeric acid-o-methyl-o-sulphate  

Type

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

Broader concept

charge

  • 0

formula

  • C12H16O9S

inchi

  • InChI=1S/C12H16O9S/c13-9(5-8-1-3-10(14)11(15)6-8)2-4-12(16)20-7-21-22(17,18)19/h1,3,6,9,13-15H,2,4-5,7H2,(H,17,18,19)

inchikey

  • YDBDCESYCNBVOY-UHFFFAOYSA-N

mass

  • 336.317

monoisotopicmass

  • 336.05150

smiles

  • C=1(C=C(C=CC1O)CC(CCC(OCOS(=O)(=O)O)=O)O)O

subset

  • 2_STAR

synonym RELATED

  • ({[5-(3,4-dihydroxyphenyl)-4-hydroxypentanoyl]oxy}methoxy)sulfonic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:88681

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