(Q105304948)

English

(2S,3R,4S,5S,6R)-2-{[(2S,3R)-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-5-(3-hydroxypropyl)-2,3-dihydro-1-benzofuran-7-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-[[2-(4-Hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-5-(3-hydroxypropyl)-2,3-dihydro-1-benzofuran-7-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol

1 reference

based on heuristic

inferred from SMILES

mass

508.194461844 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(2R,3S,4R,5R,6S)-2-[[(2R,3S)-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-5-(3-hydroxypropyl)-2,3-dihydro-1-benzofuran-7-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₅H₃₂O₁₁

0 references

canonical SMILES

OC1=CC=C(C=C1OC)C2OC3=C(OC4OC(CO)C(O)C(O)C4O)C=C(C=C3C2CO)CCCO

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isomeric SMILES

COc1cc([C@H]2Oc3c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc(CCCO)cc3[C@@H]2CO)ccc1O

0 references

found in taxon

Rhodiola crenulata

2 references

stated in

Bioactive constituents from Chinese natural medicines. XXVIII. Chemical structures of acyclic alcohol glycosides from the roots of Rhodiola crenulata

stated in

Bioactive constituents from Chinese natural medicines. XXVIII. Chemical structures of acyclic alcohol glycosides from the roots of Rhodiola crenulata

Clematis stans

2 references

stated in

Studies on the constituents of Clematis species. VI. The constituents of Clematis stans Sieb. et Zucc

stated in

Studies on the constituents of Clematis species. VI. The constituents of Clematis stans Sieb. et Zucc

Identifiers

InChI

InChI=1S/C25H32O11/c1-33-17-9-13(4-5-16(17)29)23-15(10-27)14-7-12(3-2-6-26)8-18(24(14)36-23)34-25-22(32)21(31)20(30)19(11-28)35-25/h4-5,7-9,15,19-23,25-32H,2-3,6,10-11H2,1H3/t15-,19+,20+,21-,22+,23+,25+/m0/s1

0 references

InChIKey

WGTYXIDAEFJHPD-DJSGBOIRSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

WGTYXIDAEFJHPD-DJSGBOIRSA-N

1 reference

(Q105304948)

(2S,3R,4S,5S,6R)-2-{[(2S,3R)-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-5-(3-hydroxypropyl)-2,3-dihydro-1-benzofuran-7-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol

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