(Q105261112)

English

(3aR,4R,9aS,9bR)-3-Methylene-4-(angelyloxy)-6,9-dimethyl-8-hydroxy-3,3a,4,5,9a,9b-hexahydroazuleno[4,5-b]furan-2,7-dione

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

(8-hydroxy-6,9-dimethyl-3-methylidene-2,7-dioxo-4,5,9a,9b-tetrahydro-3aH-azuleno[4,5-b]furan-4-yl) 2-methylbut-2-enoate

1 reference

based on heuristic

inferred from SMILES

mass

358.141638424 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₂₂O₆

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canonical SMILES

O=C(OC1CC(=C2C(=O)C(O)=C(C)C2C3OC(=O)C(=C)C13)C)C(=CC)C

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isomeric SMILES

C=C1C(=O)O[C@@H]2[C@H]3C(C)=C(O)C(=O)C3=C(C)C[C@@H](OC(=O)/C(C)=C\C)[C@@H]12

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found in taxon

Dendroviguiera sylvatica

1 reference

stated in

Heliangolides from Viguiera sylvatica

Identifiers

InChI

InChI=1S/C20H22O6/c1-6-8(2)19(23)25-12-7-9(3)13-15(10(4)16(21)17(13)22)18-14(12)11(5)20(24)26-18/h6,12,14-15,18,21H,5,7H2,1-4H3/b8-6-/t12-,14-,15+,18+/m1/s1

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InChIKey

SUMNDQZFWDLNGR-JHUAITPVSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

SUMNDQZFWDLNGR-JHUAITPVSA-N

1 reference

(Q105261112)

(3aR,4R,9aS,9bR)-3-Methylene-4-(angelyloxy)-6,9-dimethyl-8-hydroxy-3,3a,4,5,9a,9b-hexahydroazuleno[4,5-b]furan-2,7-dione

Statements

Identifiers

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