(Q105232973)

English

(3R,4aS,5S,6S)-5-ethenyl-3-methoxy-6-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,4a,5,6-tetrahydro-3H-pyrano[3,4-c]pyran-1-one

chemical compound

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instance of

type of chemical entity

0 references

1 reference

5-Ethenyl-6-(beta-D-glucopyranosyloxy)-4,4a,5,6-tetrahydro-3-methoxy-1H,3H-pyrano[3,4-c]pyran-1-one

1 reference

1 reference

388.136946968 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(3S,4aR,5R,6S)-5-ethenyl-3-methoxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,4a,5,6-tetrahydro-3H-pyrano[3,4-c]pyran-1-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(3S,4aS,5R,6S)-5-ethenyl-3-methoxy-6-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3H,4H,4aH,5H,6H-pyrano[3,4-c]pyran-1-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(3S,4aS,5S,6S)-5-ethenyl-3-methoxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,4a,5,6-tetrahydro-3H-pyrano[3,4-c]pyran-1-one

1 reference

based on heuristic

inferred from InChI

(3R)-5beta-Ethenyl-6alpha-(beta-D-glucopyranosyloxy)-4,4aalpha,5,6-tetrahydro-3beta-methoxy-1H,3H-pyrano[3,4-c]pyran-1-one

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₇H₂₄O₁₀

0 references

canonical SMILES

O=C1OC(OC)CC2C1=COC(OC3OC(CO)C(O)C(O)C3O)C2C=C

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isomeric SMILES

C=C[C@@H]1[C@H](O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)OC=C2C(=O)O[C@@H](OC)C[C@H]21

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found in taxon

Acicarpha tribuloides

1 reference

stated in

Modified secoiridoid from Acicarpha tribuloides and inhibition of nitric oxide production in LPS-activated macrophages

Sinoadina racemosa

1 reference

stated in

Six secoiridoid glucosides from Adina racemosa

Anthocleista vogelii

1 reference

stated in

Vogeloside and secologanic acid, secoiridoid glucosides from Anthocleista vogelii (author's transl)

Lonicera japonica

1 reference

stated in

Secoiridoid glycosides from the flower buds of Lonicera japonica

Strychnos spinosa

1 reference

stated in

Secoiridoid glucosides from Strychnos spinosa

Identifiers

InChI

InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3/t7-,8-,10-,11+,12+,13+,14-,16-,17-/m0/s1

0 references

InChIKey

RAYZRCGMIDUTKS-JLEHNCHQSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

RAYZRCGMIDUTKS-JLEHNCHQSA-N

1 reference

(Q105232973)

(3R,4aS,5S,6S)-5-ethenyl-3-methoxy-6-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,4a,5,6-tetrahydro-3H-pyrano[3,4-c]pyran-1-one

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Identifiers

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