(Q105115372)

English

(2S,3R,4S,5S,6R)-2-[4-[(3S,3aR,6S,6aR)-6-[3-hydroxy-5-methoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-3-yl]-2-hydroxy-6-methoxyphenoxy]-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-[2-Hydroxy-4-[6-[3-hydroxy-5-methoxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-3-yl]-6-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol

1 reference

based on heuristic

inferred from SMILES

mass

714.237114504 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₂H₄₂O₁₈

0 references

canonical SMILES

OC=1C=C(C=C(OC)C1OC2OC(CO)C(O)C(O)C2O)C3OCC4C(OCC34)C5=CC(O)=C(OC6OC(CO)C(O)C(O)C6O)C(OC)=C5

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isomeric SMILES

COc1cc([C@H]2OC[C@@H]3[C@@H](c4cc(O)c(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(OC)c4)OC[C@H]23)cc(O)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O

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found in taxon

Eleutherococcus senticosus

1 reference

stated in

Phenolic compounds from stem bark of Acanthopanax senticosus and their pharmacological effect in chronic swimming stressed rats

Identifiers

InChI

InChI=1S/C32H42O18/c1-43-17-5-11(3-15(35)29(17)49-31-25(41)23(39)21(37)19(7-33)47-31)27-13-9-46-28(14(13)10-45-27)12-4-16(36)30(18(6-12)44-2)50-32-26(42)24(40)22(38)20(8-34)48-32/h3-6,13-14,19-28,31-42H,7-10H2,1-2H3/t13-,14-,19+,20+,21+,22+,23-,24-,25+,26+,27+,28+,31-,32-/m0/s1

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InChIKey

ILQIFSWZVPQOKN-JBMFSIQSSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

ILQIFSWZVPQOKN-JBMFSIQSSA-N

(Q105115372)

(2S,3R,4S,5S,6R)-2-[4-[(3S,3aR,6S,6aR)-6-[3-hydroxy-5-methoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-3-yl]-2-hydroxy-6-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol

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Identifiers

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