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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 > olefinic compound > enone > chalcones > 3-(4-hydroxyphenyl)-1-/{2,4,6-trihydroxy-3,5-bis(2s,3r,4r,5s,6r)[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]phenyl/}propan-1-one
... > organooxygen compound > carbonyl compound > ketone > alpha,beta-unsaturated ketone > enone > chalcones > 3-(4-hydroxyphenyl)-1-/{2,4,6-trihydroxy-3,5-bis(2s,3r,4r,5s,6r)[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]phenyl/}propan-1-one
... > 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 > alpha,beta-unsaturated ketone > enone > chalcones > 3-(4-hydroxyphenyl)-1-/{2,4,6-trihydroxy-3,5-bis(2s,3r,4r,5s,6r)[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]phenyl/}propan-1-one
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > alpha,beta-unsaturated ketone > enone > chalcones > 3-(4-hydroxyphenyl)-1-/{2,4,6-trihydroxy-3,5-bis(2s,3r,4r,5s,6r)[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]phenyl/}propan-1-one
... > organooxygen compound > carbonyl compound > ketone > aromatic ketone > chalcones > 3-(4-hydroxyphenyl)-1-/{2,4,6-trihydroxy-3,5-bis(2s,3r,4r,5s,6r)[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]phenyl/}propan-1-one
... > 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 > aromatic ketone > chalcones > 3-(4-hydroxyphenyl)-1-/{2,4,6-trihydroxy-3,5-bis(2s,3r,4r,5s,6r)[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]phenyl/}propan-1-one
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > aromatic ketone > chalcones > 3-(4-hydroxyphenyl)-1-/{2,4,6-trihydroxy-3,5-bis(2s,3r,4r,5s,6r)[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]phenyl/}propan-1-one
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > flavonoids > chalcones > 3-(4-hydroxyphenyl)-1-/{2,4,6-trihydroxy-3,5-bis(2s,3r,4r,5s,6r)[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]phenyl/}propan-1-one

Preferred term

3-(4-hydroxyphenyl)-1-/{2,4,6-trihydroxy-3,5-bis(2s,3r,4r,5s,6r)[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]phenyl/}propan-1-one  

Type

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

Broader concept

charge

  • 0

formula

  • C27H34O15

inchi

  • InChI=1S/C27H34O15/c28-7-12-17(32)22(37)24(39)26(41-12)15-19(34)14(11(31)6-3-9-1-4-10(30)5-2-9)20(35)16(21(15)36)27-25(40)23(38)18(33)13(8-29)42-27/h1-2,4-5,12-13,17-18,22-30,32-40H,3,6-8H2/t12-,13-,17-,18-,22+,23+,24-,25-,26+,27+/m1/s1

inchikey

  • WAWHTTXPRUWFCZ-DBGLWBBTSA-N

mass

  • 598.551

monoisotopicmass

  • 598.18977

smiles

  • O1[C@]([C@H](O)[C@@H](O)[C@H](O)[C@H]1CO)(C2=C(O)C([C@@]3(O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)CO)[H])=C(O)C(=C2O)C(=O)CCC4=CC=C(O)C=C4)[H]

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:139415

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