(Q104909901)

English

(3R)-3beta-(3-Furyl)-3abeta,7-dimethyl-6beta-(beta-D-glucopyranosyloxy)-3a,4,5,6-tetrahydroisobenzofuran-1(3H)-one

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

chemical compound

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mass

410.157682412 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₂₆O₉

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canonical SMILES

O=C1OC(C2=COC=C2)C3(C1=C(C)C(OC4OC(CO)C(O)C(O)C4O)CC3)C

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isomeric SMILES

CC1=C2C(=O)O[C@@H](c3ccoc3)[C@]2(C)CC[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O

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found in taxon

Dictamnus dasycarpus

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stated in

Neuroprotective limonoids of root bark of Dictamnus dasycarpus

Identifiers

InChI

InChI=1S/C20H26O9/c1-9-11(27-19-16(24)15(23)14(22)12(7-21)28-19)3-5-20(2)13(9)18(25)29-17(20)10-4-6-26-8-10/h4,6,8,11-12,14-17,19,21-24H,3,5,7H2,1-2H3/t11-,12-,14-,15+,16-,17+,19-,20-/m1/s1

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InChIKey

ADZBWASOZUDACU-NRKKNTPLSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

ADZBWASOZUDACU-NRKKNTPLSA-N

1 reference

(Q104909901)

(3R)-3beta-(3-Furyl)-3abeta,7-dimethyl-6beta-(beta-D-glucopyranosyloxy)-3a,4,5,6-tetrahydroisobenzofuran-1(3H)-one

Statements

Identifiers

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