(Q105089647)

English

[(3aS,5R,6S,6aS,7S,9aR,9bR)-7-acetyloxy-6-hydroxy-6,9-dimethyl-3-methylidene-2-oxo-4,5,6a,7,9a,9b-hexahydro-3aH-azuleno[4,5-b]furan-5-yl] acetate

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

(7-acetyloxy-6-hydroxy-6,9-dimethyl-3-methylidene-2-oxo-4,5,6a,7,9a,9b-hexahydro-3aH-azuleno[4,5-b]furan-5-yl) acetate

1 reference

based on heuristic

inferred from SMILES

mass

364.152203108 dalton

1 reference

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₁₉H₂₄O₇

0 references

canonical SMILES

O=C1OC2C(C1=C)CC(OC(=O)C)C(O)(C)C3C(OC(=O)C)C=C(C)C23

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isomeric SMILES

C=C1C(=O)O[C@@H]2[C@H]1C[C@@H](OC(C)=O)[C@@](C)(O)[C@@H]1[C@@H](OC(C)=O)C=C(C)[C@@H]12

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found in taxon

Anthemis aetnensis

1 reference

stated in

Sesquiterpene lactones as chemotaxonomic markers in genus Anthemis

Anthemis hydruntina

1 reference

stated in

Sesquiterpene lactones as chemotaxonomic markers in genus Anthemis

Identifiers

InChI

InChI=1S/C19H24O7/c1-8-6-13(24-10(3)20)16-15(8)17-12(9(2)18(22)26-17)7-14(19(16,5)23)25-11(4)21/h6,12-17,23H,2,7H2,1,3-5H3/t12-,13-,14+,15-,16+,17+,19+/m0/s1

0 references

InChIKey

IBQQQNOIJPGTGI-HAXRXIHTSA-N

0 references

1 reference

17 September 2022

inferred from InChIKey

(Q105089647)

[(3aS,5R,6S,6aS,7S,9aR,9bR)-7-acetyloxy-6-hydroxy-6,9-dimethyl-3-methylidene-2-oxo-4,5,6a,7,9a,9b-hexahydro-3aH-azuleno[4,5-b]furan-5-yl] acetate

Statements

Identifiers

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