(Q104985617)

English

(2S)-2alpha-(3-Methoxy-4-hydroxyphenyl)-5-[(E)-3-(beta-D-glucopyranosyloxy)-1-propenyl]-7-methoxy-2,3-dihydrobenzofuran-3beta-methanol

chemical compound

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instance of

type of chemical entity

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subclass of

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

1 reference

based on heuristic

inferred from SMILES

mass

520.194461844 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

Dehydrodiconiferyl alcohol gamma'-O-beta-D-glucopyranoside

1 reference

based on heuristic

inferred from InChI

(2R,3R,4S,5S,6R)-2-[(Z)-3-[(2R,3S)-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]prop-2-enoxy]-6-(hydroxymethyl)oxane-3,4,5-triol

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₆H₃₂O₁₁

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canonical SMILES

OC1=CC=C(C=C1OC)C2OC3=C(OC)C=C(C=CCOC4OC(CO)C(O)C(O)C4O)C=C3C2CO

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isomeric SMILES

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

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found in taxon

Phlomoides tuberosa

1 reference

stated in

Iridoid Glucosides from Turkish Phlomis tuberosa

Identifiers

InChI

InChI=1S/C26H32O11/c1-33-18-10-14(5-6-17(18)29)24-16(11-27)15-8-13(9-19(34-2)25(15)37-24)4-3-7-35-26-23(32)22(31)21(30)20(12-28)36-26/h3-6,8-10,16,20-24,26-32H,7,11-12H2,1-2H3/b4-3+/t16-,20+,21+,22-,23+,24+,26+/m0/s1

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InChIKey

DNLHOETWTCLNEI-QXGRHDLQSA-N

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2 references

26 December 2021

matched by identifier from

InChIKey

DNLHOETWTCLNEI-QXGRHDLQSA-N

1 reference

(Q104985617)

(2S)-2alpha-(3-Methoxy-4-hydroxyphenyl)-5-[(E)-3-(beta-D-glucopyranosyloxy)-1-propenyl]-7-methoxy-2,3-dihydrobenzofuran-3beta-methanol

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