(Q105311590)

English

(2R,3R,4R,5R,6R)-2-[(3S,5R)-5-hydroxy-1,7-bis(4-hydroxyphenyl)heptan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol

chemical compound

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instance of

type of chemical entity

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subclass of

2-[5-Hydroxy-1,7-bis(4-hydroxyphenyl)heptan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol

1 reference

based on heuristic

inferred from SMILES

mass

478.220282668 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(2R,3R,4S,5S,6R)-2-[(3R,5R)-5-hydroxy-1,7-bis(4-hydroxyphenyl)heptan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol

1 reference

based on heuristic

inferred from InChI

(2R,3R,4R,5R,6R)-2-[(3S,5S)-5-hydroxy-1,7-bis(4-hydroxyphenyl)heptan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₅H₃₄O₉

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canonical SMILES

OC1=CC=C(C=C1)CCC(O)CC(OC2OC(CO)C(O)C(O)C2O)CCC3=CC=C(O)C=C3

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isomeric SMILES

OC[C@H]1O[C@@H](O[C@@H](CCc2ccc(O)cc2)C[C@H](O)CCc2ccc(O)cc2)[C@H](O)[C@H](O)[C@H]1O

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found in taxon

Betula platyphylla var. japonica

1 reference

stated in

Hepatoprotective, superoxide scavenging, and antioxidative activities of aromatic constituents from the bark of Betula platyphylla var. japonica

Identifiers

InChI

InChI=1S/C25H34O9/c26-14-21-22(30)23(31)24(32)25(34-21)33-20(12-6-16-3-9-18(28)10-4-16)13-19(29)11-5-15-1-7-17(27)8-2-15/h1-4,7-10,19-32H,5-6,11-14H2/t19-,20+,21-,22+,23-,24-,25-/m1/s1

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InChIKey

WRUJLWFLDOUUHV-QVQNJILUSA-N

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2 references

26 December 2021

matched by identifier from

InChIKey

WRUJLWFLDOUUHV-QVQNJILUSA-N

1 reference

(Q105311590)

(2R,3R,4R,5R,6R)-2-[(3S,5R)-5-hydroxy-1,7-bis(4-hydroxyphenyl)heptan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol

Statements

Identifiers

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