(Q105257203)

English

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

chemical compound

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Statements

type of chemical entity

0 references

(3aR,4S,9bR)-6,9-dimethyl-3-methylidene-2,7-dioxo-3aH,4H,5H,9aH,9bH-azuleno[4,5-b]furan-4-yl (2Z)-2-methylbut-2-enoate

1 reference

based on heuristic

inferred from SMILES

(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

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

1 reference

based on heuristic

inferred from SMILES

342.146723804 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

phenylethyl n-octacosanoate

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

[(3aR,4R,9aS,9bS)-6,9-dimethyl-3-methylidene-2,7-dioxo-4,5,9a,9b-tetrahydro-3aH-azuleno[4,5-b]furan-4-yl] (E)-2-methylbut-2-enoate

1 reference

based on heuristic

inferred from InChI

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

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₀H₂₂O₅

0 references

canonical SMILES

O=C(OC1CC(=C2C(=O)C=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)=CC(=O)C3=C(C)C[C@@H](OC(=O)/C(C)=C\C)[C@H]12

0 references

Stevia sanguinea

1 reference

Guaianolides from Stevia sanguinea

Identifiers

InChI=1S/C20H22O5/c1-6-9(2)19(22)24-14-8-11(4)15-13(21)7-10(3)16(15)18-17(14)12(5)20(23)25-18/h6-7,14,16-18H,5,8H2,1-4H3/b9-6-/t14-,16+,17+,18+/m1/s1

0 references

SOUHOZAOAMAEFT-HEVMUVMHSA-N

0 references

1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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