(Q105291444)

English

[(3S,4R,5R)-5-[[(2R,3S,4S,5R,6R)-6-[(R)-cyano(phenyl)methoxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-3,4-dihydroxyoxolan-3-yl]methyl benzoate

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

[5-[[6-[Cyano(phenyl)methoxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-3,4-dihydroxyoxolan-3-yl]methyl benzoate

1 reference

based on heuristic

inferred from SMILES

mass

531.174060748 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₆H₂₉NO₁₁

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canonical SMILES

N#CC(OC1OC(COC2OCC(O)(COC(=O)C=3C=CC=CC3)C2O)C(O)C(O)C1O)C=4C=CC=CC4

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isomeric SMILES

N#C[C@H](O[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(COC(=O)c3ccccc3)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1

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found in taxon

Psydrax livida

1 reference

stated in

Cyanogenic glycosides from PS Psydrax and Oxyanthus species[a/t]

Identifiers

InChI

InChI=1S/C26H29NO11/c27-11-17(15-7-3-1-4-8-15)37-24-21(30)20(29)19(28)18(38-24)12-34-25-22(31)26(33,14-36-25)13-35-23(32)16-9-5-2-6-10-16/h1-10,17-22,24-25,28-31,33H,12-14H2/t17-,18+,19+,20-,21+,22-,24+,25+,26+/m0/s1

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InChIKey

VQRFNQHZPFHUSV-BYQUYGEWSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

VQRFNQHZPFHUSV-BYQUYGEWSA-N

(Q105291444)

[(3S,4R,5R)-5-[[(2R,3S,4S,5R,6R)-6-[(R)-cyano(phenyl)methoxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-3,4-dihydroxyoxolan-3-yl]methyl benzoate

Statements

Identifiers

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