(Q105351776)

English

Acetic acid [(2S)-2alpha,5alpha-bis(4-methoxy-1,3-benzodioxole-6-yl)-3beta-(hydroxymethyl)tetrahydrofuran]-4alpha-ylmethyl ester

chemical compound

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instance of

type of chemical entity

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subclass of

[4-(Hydroxymethyl)-2,5-bis(7-methoxy-1,3-benzodioxol-5-yl)oxolan-3-yl]methyl acetate

1 reference

based on heuristic

inferred from SMILES

mass

474.152597032 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

Acetic acid [(2S)-2alpha,5alpha-bis(4-methoxy-1,3-benzodioxole-6-yl)-4alpha-(hydroxymethyl)tetrahydrofuran]-3beta-ylmethyl ester

1 reference

based on heuristic

inferred from InChI

[(2S,3S,4S,5R)-4-(hydroxymethyl)-2,5-bis(7-methoxy-1,3-benzodioxol-5-yl)oxolan-3-yl]methyl acetate

1 reference

based on heuristic

inferred from InChI

Acetic acid [(2S)-2alpha,5beta-bis(4-methoxy-1,3-benzodioxole-6-yl)-4alpha-(hydroxymethyl)tetrahydrofuran]-3beta-ylmethyl ester

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₄H₂₆O₁₀

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canonical SMILES

O=C(OCC1C(OC(C2=CC(OC)=C3OCOC3=C2)C1CO)C4=CC(OC)=C5OCOC5=C4)C

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isomeric SMILES

COc1cc([C@H]2O[C@@H](c3cc(OC)c4c(c3)OCO4)[C@@H](COC(C)=O)[C@@H]2CO)cc2c1OCO2

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found in taxon

Peperomia dindygulensis

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stated in

Bioactive tetrahydrofuran lignans from Peperomia dindygulensis

Peperomia leptostachya

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stated in

Bioactive tetrahydrofuran lignans from Peperomia dindygulensis

Peperomia humilis

1 reference

stated in

Bioactive tetrahydrofuran lignans from Peperomia dindygulensis

Identifiers

InChI

InChI=1S/C24H26O10/c1-12(26)29-9-16-15(8-25)21(13-4-17(27-2)23-19(6-13)30-10-32-23)34-22(16)14-5-18(28-3)24-20(7-14)31-11-33-24/h4-7,15-16,21-22,25H,8-11H2,1-3H3/t15-,16-,21+,22-/m0/s1

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InChIKey

YPQDTAINIDFHAR-FRMGNDQPSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

YPQDTAINIDFHAR-FRMGNDQPSA-N

1 reference

(Q105351776)

Acetic acid [(2S)-2alpha,5alpha-bis(4-methoxy-1,3-benzodioxole-6-yl)-3beta-(hydroxymethyl)tetrahydrofuran]-4alpha-ylmethyl ester

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Identifiers

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