(Q105004765)

English

(2S,3R,4R,5R,6S)-2-[4-[(2S,3R)-3-(hydroxymethyl)-5-(3-hydroxypropyl)-7-methoxy-2,3-dihydro-1-benzofuran-2-yl]-2-methoxyphenoxy]-6-methyloxane-3,4,5-triol

chemical compound

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instance of

type of chemical entity

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subclass of

2-{4-[3-(hydroxymethyl)-5-(3-hydroxypropyl)-7-methoxy-2,3-dihydro-1-benzofuran-2-yl]-2-methoxyphenoxy}-6-methyloxane-3,4,5-triol

1 reference

based on heuristic

inferred from SMILES

mass

506.215197288 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(2S,3R,4R,5R,6S)-2-[4-[(2S,3S)-3-(hydroxymethyl)-5-(3-hydroxypropyl)-7-methoxy-2,3-dihydro-1-benzofuran-2-yl]-2-methoxyphenoxy]-6-methyloxane-3,4,5-triol

1 reference

based on heuristic

inferred from InChIKey

(2R,3R,4R,5R,6S)-2-[4-[(2R,3R)-3-(hydroxymethyl)-5-(3-hydroxypropyl)-7-methoxy-2,3-dihydro-1-benzofuran-2-yl]-2-methoxyphenoxy]-6-methyloxane-3,4,5-triol

1 reference

based on heuristic

inferred from InChI

(2S,3R,4R,5R,6S)-2-[4-[(2R,3R)-3-(hydroxymethyl)-5-(3-hydroxypropyl)-7-methoxy-2,3-dihydro-1-benzofuran-2-yl]-2-methoxyphenoxy]-6-methyloxane-3,4,5-triol

1 reference

1 reference

C₂₆H₃₄O₁₀

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canonical SMILES

OCCCC1=CC(OC)=C2OC(C3=CC=C(OC4OC(C)C(O)C(O)C4O)C(OC)=C3)C(C2=C1)CO

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isomeric SMILES

COc1cc([C@H]2Oc3c(OC)cc(CCCO)cc3[C@@H]2CO)ccc1O[C@@H]1O[C@@H](C)[C@H](O)[C@@H](O)[C@H]1O

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found in taxon

Pseudotsuga menziesii

1 reference

stated in

Neolignan glycosides from Pseudotsuga menziesii

Identifiers

InChI

InChI=1S/C26H34O10/c1-13-21(29)22(30)23(31)26(34-13)35-18-7-6-15(11-19(18)32-2)24-17(12-28)16-9-14(5-4-8-27)10-20(33-3)25(16)36-24/h6-7,9-11,13,17,21-24,26-31H,4-5,8,12H2,1-3H3/t13-,17-,21-,22+,23+,24+,26-/m0/s1

0 references

InChIKey

FYWCDZKQBWSMDD-IPMGADGGSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

FYWCDZKQBWSMDD-IPMGADGGSA-N

(Q105004765)

(2S,3R,4R,5R,6S)-2-[4-[(2S,3R)-3-(hydroxymethyl)-5-(3-hydroxypropyl)-7-methoxy-2,3-dihydro-1-benzofuran-2-yl]-2-methoxyphenoxy]-6-methyloxane-3,4,5-triol

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