(Q104938656)

English

(2S)-5-hydroxy-2-(4-hydroxyphenyl)-8-(3-methylbut-2-en-1-yl)-7-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,3-dihydro-1-benzopyran-4-one

chemical compound

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type of chemical entity

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1 reference

(2S)-7-(beta-D-Glucopyranosyloxy)-2,3-dihydro-5-hydroxy-2-(4-hydroxyphenyl)-8-(3-methyl-2-buten-1-yl)-4H-1-benzopyran-4-one; Flavaprin

1 reference

based on heuristic

inferred from SMILES

mass

502.18389716 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(2R)-5-hydroxy-2-(4-hydroxyphenyl)-8-(3-methylbut-2-en-1-yl)-7-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,3-dihydro-1-benzopyran-4-one

1 reference

1 reference

C₂₆H₃₀O₁₀

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canonical SMILES

O=C1C2=C(O)C=C(OC3OC(CO)C(O)C(O)C3O)C(=C2OC(C4=CC=C(O)C=C4)C1)CC=C(C)C

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isomeric SMILES

CC(C)=CCc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(O)c2c1O[C@H](c1ccc(O)cc1)CC2=O

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found in taxon

Phellodendron chinense var. glabriusculum

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stated in

Constituents of Leaves of Phellodendron chinense var. glabriusculum

Tetradium daniellii

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stated in

Constituents of the fruits and leaves of Euodia daniellii

Identifiers

InChI

InChI=1S/C26H30O10/c1-12(2)3-8-15-19(35-26-24(33)23(32)22(31)20(11-27)36-26)10-17(30)21-16(29)9-18(34-25(15)21)13-4-6-14(28)7-5-13/h3-7,10,18,20,22-24,26-28,30-33H,8-9,11H2,1-2H3/t18-,20+,22+,23-,24+,26+/m0/s1

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InChIKey

BMYUIXRQCPBGKG-WTYMVSKMSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

BMYUIXRQCPBGKG-WTYMVSKMSA-N

1 reference

(Q104938656)

(2S)-5-hydroxy-2-(4-hydroxyphenyl)-8-(3-methylbut-2-en-1-yl)-7-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,3-dihydro-1-benzopyran-4-one

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