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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 > 1-[2,4,6-trihydroxy-3,5-bis(beta-d-glucopyranosyl)phenyl]-3-phenyl-1-propanone
... > organooxygen compound > carbonyl compound > ketone > alpha,beta-unsaturated ketone > enone > chalcones > 1-[2,4,6-trihydroxy-3,5-bis(beta-d-glucopyranosyl)phenyl]-3-phenyl-1-propanone
... > 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 > 1-[2,4,6-trihydroxy-3,5-bis(beta-d-glucopyranosyl)phenyl]-3-phenyl-1-propanone
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > alpha,beta-unsaturated ketone > enone > chalcones > 1-[2,4,6-trihydroxy-3,5-bis(beta-d-glucopyranosyl)phenyl]-3-phenyl-1-propanone
... > organooxygen compound > carbonyl compound > ketone > aromatic ketone > chalcones > 1-[2,4,6-trihydroxy-3,5-bis(beta-d-glucopyranosyl)phenyl]-3-phenyl-1-propanone
... > 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 > 1-[2,4,6-trihydroxy-3,5-bis(beta-d-glucopyranosyl)phenyl]-3-phenyl-1-propanone
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > aromatic ketone > chalcones > 1-[2,4,6-trihydroxy-3,5-bis(beta-d-glucopyranosyl)phenyl]-3-phenyl-1-propanone
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > flavonoids > chalcones > 1-[2,4,6-trihydroxy-3,5-bis(beta-d-glucopyranosyl)phenyl]-3-phenyl-1-propanone

Preferred term

1-[2,4,6-trihydroxy-3,5-bis(beta-d-glucopyranosyl)phenyl]-3-phenyl-1-propanone  

Type

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

Broader concept

charge

  • 0

formula

  • C27H34O14

inchi

  • InChI=1S/C27H34O14/c28-8-12-17(31)22(36)24(38)26(40-12)15-19(33)14(11(30)7-6-10-4-2-1-3-5-10)20(34)16(21(15)35)27-25(39)23(37)18(32)13(9-29)41-27/h1-5,12-13,17-18,22-29,31-39H,6-9H2/t12-,13-,17-,18-,22+,23+,24-,25-,26+,27+/m1/s1

inchikey

  • OMPFZUXZCIVLSI-DBGLWBBTSA-N

mass

  • 582.555

monoisotopicmass

  • 582.19486

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=CC=C4)[H]

subset

  • 2_STAR

synonym EXACT

  • 3-phenyl-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

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:182580

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