(Q105199232)

English

(2S,3R,4S,5S,6R)-2-{4-[(2S,3R,4R)-4-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]-3-(hydroxymethyl)oxolan-2-yl]-2,6-dimethoxyphenoxy}-6-(hydroxymethyl)oxane-3,4,5-triol

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

2,6-Dimethoxy-4-[tetrahydro-4-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]-3-(hydroxymethyl)-2-furanyl]phenyl beta-D-glucopyranoside

1 reference

based on heuristic

inferred from SMILES

mass

582.231241276 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

5,5'-Dimethyllariciresinol 4'-glucopyranoside

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₈H₃₈O₁₃

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canonical SMILES

OC1=C(OC)C=C(C=C1OC)CC2COC(C3=CC(OC)=C(OC4OC(CO)C(O)C(O)C4O)C(OC)=C3)C2CO

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isomeric SMILES

COc1cc(C[C@H]2CO[C@H](c3cc(OC)c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c3)[C@H]2CO)cc(OC)c1O

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found in taxon

Phellodendron amurense

1 reference

stated in

Phenolic constituents of phellodendron amurense bark

Identifiers

InChI

InChI=1S/C28H38O13/c1-35-17-6-13(7-18(36-2)22(17)31)5-15-12-39-26(16(15)10-29)14-8-19(37-3)27(20(9-14)38-4)41-28-25(34)24(33)23(32)21(11-30)40-28/h6-9,15-16,21,23-26,28-34H,5,10-12H2,1-4H3/t15-,16-,21+,23+,24-,25+,26+,28-/m0/s1

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InChIKey

OSPNTYPNEPEMIS-HEZPOBQYSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

OSPNTYPNEPEMIS-HEZPOBQYSA-N

1 reference

(Q105199232)

(2S,3R,4S,5S,6R)-2-{4-[(2S,3R,4R)-4-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]-3-(hydroxymethyl)oxolan-2-yl]-2,6-dimethoxyphenoxy}-6-(hydroxymethyl)oxane-3,4,5-triol

Statements

Identifiers

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