(Q105235087)

English

[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (2S,4aR,6aR,10aR,10bS)-2-(furan-3-yl)-6a,10b-dimethyl-4-oxo-1,2,4a,5,6,9,10,10a-octahydrobenzo[f]isochromene-7-carboxylate

chemical compound

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instance of

type of chemical entity

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subclass of

[3,4,5-Trihydroxy-6-(hydroxymethyl)oxan-2-yl] 2-(furan-3-yl)-6a,10b-dimethyl-4-oxo-1,2,4a,5,6,9,10,10a-octahydrobenzo[f]isochromene-7-carboxylate

1 reference

based on heuristic

inferred from SMILES

mass

506.215197288 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

Floribundic acid glucoside

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₆H₃₄O₁₀

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canonical SMILES

O=C(OC1OC(CO)C(O)C(O)C1O)C2=CCCC3C2(C)CCC4C(=O)OC(C5=COC=C5)CC43C

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isomeric SMILES

C[C@@]12C[C@@H](c3ccoc3)OC(=O)[C@@H]1CC[C@@]1(C)C(C(=O)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)=CCC[C@H]21

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found in taxon

Croton lechleri

1 reference

stated in

Identification of minor secondary metabolites from the latex of Croton lechleri (Muell-Arg) and evaluation of their antioxidant activity

Identifiers

InChI

InChI=1S/C26H34O10/c1-25-8-6-15-22(31)34-16(13-7-9-33-12-13)10-26(15,2)18(25)5-3-4-14(25)23(32)36-24-21(30)20(29)19(28)17(11-27)35-24/h4,7,9,12,15-21,24,27-30H,3,5-6,8,10-11H2,1-2H3/t15-,16-,17+,18-,19+,20-,21+,24-,25-,26+/m0/s1

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InChIKey

RETJNOLVDRGHMX-MRQRZHJNSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

RETJNOLVDRGHMX-MRQRZHJNSA-N

(Q105235087)

[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (2S,4aR,6aR,10aR,10bS)-2-(furan-3-yl)-6a,10b-dimethyl-4-oxo-1,2,4a,5,6,9,10,10a-octahydrobenzo[f]isochromene-7-carboxylate

Statements

Identifiers

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