(Q105013775)

English

[(3S,4R,5R)-5-[[(2S,3R,4R,5R,6R)-6-(3,4-dimethoxyphenoxy)-3,4,5-trihydroxyoxan-2-yl]methoxy]-3,4-dihydroxyoxolan-3-yl]methyl 3,4-dimethoxybenzoate

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

[5-[[6-(3,4-Dimethoxyphenoxy)-3,4,5-trihydroxyoxan-2-yl]methoxy]-3,4-dihydroxyoxolan-3-yl]methyl 3,4-dimethoxybenzoate

1 reference

based on heuristic

inferred from SMILES

mass

612.205420452 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

3,4-Dimethoxyphenyl 6-O-[5-O-(3,4-dimethoxybenzoyl)-D-apio-beta-D-furanosyl]-beta-D-glucopyranoside

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₈H₃₆O₁₅

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canonical SMILES

O=C(OCC1(O)COC(OCC2OC(OC3=CC=C(OC)C(OC)=C3)C(O)C(O)C2O)C1O)C4=CC=C(OC)C(OC)=C4

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isomeric SMILES

COc1ccc(O[C@H]2O[C@@H](CO[C@@H]3OC[C@](O)(COC(=O)c4ccc(OC)c(OC)c4)[C@H]3O)[C@H](O)[C@@H](O)[C@H]2O)cc1OC

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found in taxon

Handroanthus impetiginosum

1 reference

stated in

Constituents from the bark of Tabebuia impetiginosa

Handroanthus impetiginosus

1 reference

stated in

Constituents from the bark of Tabebuia impetiginosa

Identifiers

InChI

InChI=1S/C28H36O15/c1-35-16-7-5-14(9-18(16)37-3)25(33)40-12-28(34)13-41-27(24(28)32)39-11-20-21(29)22(30)23(31)26(43-20)42-15-6-8-17(36-2)19(10-15)38-4/h5-10,20-24,26-27,29-32,34H,11-13H2,1-4H3/t20-,21-,22+,23+,24-,26-,27+,28+/m0/s1

0 references

InChIKey

GOEIYALPGAXEEK-VNZFLSIRSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

GOEIYALPGAXEEK-VNZFLSIRSA-N

(Q105013775)

[(3S,4R,5R)-5-[[(2S,3R,4R,5R,6R)-6-(3,4-dimethoxyphenoxy)-3,4,5-trihydroxyoxan-2-yl]methoxy]-3,4-dihydroxyoxolan-3-yl]methyl 3,4-dimethoxybenzoate

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