(Q104968623)

English

(3R,3aR,6R)-3-(furan-2-yl)-3a,7-dimethyl-6-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4,5,6-tetrahydro-2-benzofuran-1-one

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

3-(Furan-2-yl)-3a,7-dimethyl-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4,5,6-tetrahydro-2-benzofuran-1-one

1 reference

based on heuristic

inferred from SMILES

mass

410.157682412 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₂₆O₉

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canonical SMILES

O=C1OC(C=2OC=CC2)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](c3ccco3)[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

1 reference

stated in

Neuroprotective limonoids of root bark of Dictamnus dasycarpus

Identifiers

InChI

InChI=1S/C20H26O9/c1-9-10(27-19-16(24)15(23)14(22)12(8-21)28-19)5-6-20(2)13(9)18(25)29-17(20)11-4-3-7-26-11/h3-4,7,10,12,14-17,19,21-24H,5-6,8H2,1-2H3/t10-,12-,14-,15+,16-,17+,19-,20-/m1/s1

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InChIKey

CROARAMJLBWSDA-WDONTMOLSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

CROARAMJLBWSDA-WDONTMOLSA-N

(Q104968623)

(3R,3aR,6R)-3-(furan-2-yl)-3a,7-dimethyl-6-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4,5,6-tetrahydro-2-benzofuran-1-one

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