(Q104914150)

English

2alpha-(3,4-Dihydroxyphenyl)-3beta,5,7-trihydroxy-6-(3-oxobutyl)-2H-1-benzopyran-4(3H)-one

chemical compound

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Statements

type of chemical entity

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6C-substituted flavanone

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374.100167536 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₉H₁₈O₈

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canonical SMILES

O=C1C2=C(O)C(=C(O)C=C2OC(C3=CC=C(O)C(O)=C3)C1O)CCC(=O)C

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isomeric SMILES

CC(=O)CCc1c(O)cc2c(c1O)C(=O)[C@H](O)[C@@H](c1ccc(O)c(O)c1)O2

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Bauhinia purpurea

1 reference

A novel 6-butyl-3-hydroxyflavanone from heartwood of Bauhinia purpurea

Identifiers

InChI=1S/C19H18O8/c1-8(20)2-4-10-12(22)7-14-15(16(10)24)17(25)18(26)19(27-14)9-3-5-11(21)13(23)6-9/h3,5-7,18-19,21-24,26H,2,4H2,1H3/t18-,19+/m0/s1

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ALIOKRACUZLOCC-RBUKOAKNSA-N

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1 reference

17 September 2022

based on heuristic

inferred from InChIKey

UniChem compound ID

1 reference

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