(Q105203473)

English

(1S,4aS,6S,7S,7aS)-6-hydroxy-7-methyl-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carbaldehyde

chemical compound

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instance of

type of chemical entity

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subclass of

6-Hydroxy-7-methyl-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carbaldehyde

1 reference

based on heuristic

inferred from SMILES

mass

360.142032348 dalton

1 reference

1 reference

(1S,4aS,6S,7R,7aR)-6-hydroxy-7-methyl-1-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carbaldehyde

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₆H₂₄O₉

0 references

canonical SMILES

O=CC1=COC(OC2OC(CO)C(O)C(O)C2O)C3C1CC(O)C3C

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isomeric SMILES

C[C@@H]1[C@@H](O)C[C@@H]2C(C=O)=CO[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]21

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found in taxon

Euphrasia nemorosa

1 reference

stated in

Iridoid glycosides ofEuphrasia pectinata

Euphrasia pectinata

1 reference

stated in

Iridoid glycosides ofEuphrasia pectinata

Identifiers

InChI

InChI=1S/C16H24O9/c1-6-9(19)2-8-7(3-17)5-23-15(11(6)8)25-16-14(22)13(21)12(20)10(4-18)24-16/h3,5-6,8-16,18-22H,2,4H2,1H3/t6-,8-,9+,10-,11-,12-,13+,14-,15+,16-/m1/s1

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InChIKey

OYOXNRVULYNDRW-SNXRZMTMSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

OYOXNRVULYNDRW-SNXRZMTMSA-N

(Q105203473)

(1S,4aS,6S,7S,7aS)-6-hydroxy-7-methyl-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carbaldehyde

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