(Q105242295)

English

[(2R,3S,4S,5R,6S)-6-[(2S,3R,4R,5S,6S)-2-[5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxochromen-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl acetate

chemical compound

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instance of

type of chemical entity

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subclass of

[6-[2-[5,7-Dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxochromen-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl acetate

1 reference

based on heuristic

inferred from SMILES

mass

682.174514248 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

2-(4-Hydroxy-3-methoxyphenyl)-3-[3-O-(6-O-acetyl-beta-D-glucopyranosyl)-beta-D-galactopyranosyloxy]-5,7-dihydroxy-4H-1-benzopyran-4-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₃₀H₃₄O₁₈

0 references

canonical SMILES

O=C(OCC1OC(OC2C(O)C(OC=3C(=O)C=4C(O)=CC(O)=CC4OC3C=5C=CC(O)=C(OC)C5)OC(CO)C2O)C(O)C(O)C1O)C

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isomeric SMILES

COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O[C@@H]3O[C@H](COC(C)=O)[C@@H](O)[C@H](O)[C@H]3O)[C@H]2O)ccc1O

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found in taxon

Achlys triphylla

1 reference

stated in

Four flavonol glycosides from Achlys triphylla

Identifiers

InChI

InChI=1S/C30H34O18/c1-10(32)43-9-18-20(36)23(39)24(40)29(46-18)47-27-21(37)17(8-31)45-30(25(27)41)48-28-22(38)19-14(35)6-12(33)7-16(19)44-26(28)11-3-4-13(34)15(5-11)42-2/h3-7,17-18,20-21,23-25,27,29-31,33-37,39-41H,8-9H2,1-2H3/t17-,18+,20+,21-,23-,24+,25+,27+,29-,30-/m0/s1

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InChIKey

ROLNEHAFRSGZQP-IYMUOUMRSA-N

0 references

1 reference

17 September 2022

inferred from InChIKey

(Q105242295)

[(2R,3S,4S,5R,6S)-6-[(2S,3R,4R,5S,6S)-2-[5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxochromen-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl acetate

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Identifiers

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