(Q105176761)

English

(2R,3R,4S,5R,6R)-2-[[(2R,3R,4S,5R,6R)-6-[3-[2-(1,3-benzodioxol-5-yl)-7-methoxy-1-benzofuran-5-yl]propoxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol

chemical compound

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Statements

instance of

type of chemical entity

0 references

1 reference

650.221070516 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

Egonol beta-gentiobioside

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₁H₃₈O₁₅

0 references

canonical SMILES

OCC1OC(OCC2OC(OCCCC3=CC(OC)=C4OC(=CC4=C3)C=5C=CC=6OCOC6C5)C(O)C(O)C2O)C(O)C(O)C1O

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isomeric SMILES

COc1cc(CCCO[C@@H]2O[C@H](CO[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)cc2cc(-c3ccc4c(c3)OCO4)oc12

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found in taxon

Laetiporus sulphureus var. miniatus

1 reference

stated in

A benzofuran glycoside and an acetylenic acid from the fungus Laetiporus sulphureus var. miniatus

Identifiers

InChI

InChI=1S/C31H38O15/c1-39-20-8-14(7-16-10-18(44-29(16)20)15-4-5-17-19(9-15)43-13-42-17)3-2-6-40-30-27(37)26(36)24(34)22(46-30)12-41-31-28(38)25(35)23(33)21(11-32)45-31/h4-5,7-10,21-28,30-38H,2-3,6,11-13H2,1H3/t21-,22-,23+,24+,25+,26+,27-,28-,30-,31-/m1/s1

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InChIKey

NBGJGWFIDMDCAW-WBCGDKOGSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

NBGJGWFIDMDCAW-WBCGDKOGSA-N

(Q105176761)

(2R,3R,4S,5R,6R)-2-[[(2R,3R,4S,5R,6R)-6-[3-[2-(1,3-benzodioxol-5-yl)-7-methoxy-1-benzofuran-5-yl]propoxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol

Statements

Identifiers

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