(Q105305394)

English

[(1R,2S)-1-(3-hydroxy-4,5-dimethoxyphenyl)-2-methyl-3-oxobutyl] 1,3-benzodioxole-5-carboxylate

chemical compound

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instance of

type of chemical entity

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subclass of

chemical compound

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mass

402.131467664 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₁H₂₂O₈

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canonical SMILES

O=C(OC(C1=CC(O)=C(OC)C(OC)=C1)C(C(=O)C)C)C2=CC=C3OCOC3=C2

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isomeric SMILES

COc1cc([C@H](OC(=O)c2ccc3c(c2)OCO3)[C@H](C)C(C)=O)cc(O)c1OC

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found in taxon

Schisandra wilsoniana

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stated in

7,8-secolignans from Schisandra wilsoniana and their anti-HIV-1 activities

Schisandra bicolor

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stated in

7,8-secolignans from Schisandra wilsoniana and their anti-HIV-1 activities

Identifiers

InChI

InChI=1S/C21H22O8/c1-11(12(2)22)19(14-7-15(23)20(26-4)18(9-14)25-3)29-21(24)13-5-6-16-17(8-13)28-10-27-16/h5-9,11,19,23H,10H2,1-4H3/t11-,19-/m1/s1

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InChIKey

WHKZKHOWQVYOSG-NSPYISDASA-N

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2 references

26 December 2021

matched by identifier from

InChIKey

WHKZKHOWQVYOSG-NSPYISDASA-N

1 reference

(Q105305394)

[(1R,2S)-1-(3-hydroxy-4,5-dimethoxyphenyl)-2-methyl-3-oxobutyl] 1,3-benzodioxole-5-carboxylate

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Identifiers

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