(Q105197038)

English

[(3aS,4R,5R,6S,6aS,9S,9aS,9bR)-9-hydroperoxy-4,6-dihydroxy-6,9-dimethyl-3-methylidene-2-oxo-3a,4,5,6a,9a,9b-hexahydroazuleno[4,5-b]furan-5-yl] acetate

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

(9-Hydroperoxy-4,6-dihydroxy-6,9-dimethyl-3-methylidene-2-oxo-3a,4,5,6a,9a,9b-hexahydroazuleno[4,5-b]furan-5-yl) acetate

1 reference

based on heuristic

inferred from SMILES

mass

354.131467664 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

9-O-Acetylanthemolide B

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₁₇H₂₂O₈

0 references

canonical SMILES

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

0 references

isomeric SMILES

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

0 references

found in taxon

Anthemis carpatica

1 reference

stated in

Sesquiterpene lactones as chemotaxonomic markers in genus Anthemis

Identifiers

InChI

InChI=1S/C17H22O8/c1-7-10-12(19)14(23-8(2)18)17(4,21)9-5-6-16(3,25-22)11(9)13(10)24-15(7)20/h5-6,9-14,19,21-22H,1H2,2-4H3/t9-,10-,11-,12+,13+,14+,16-,17-/m0/s1

0 references

InChIKey

OQNCVYGKABLVLD-FHHPYWGISA-N

0 references

1 reference

17 September 2022

inferred from InChIKey

(Q105197038)

[(3aS,4R,5R,6S,6aS,9S,9aS,9bR)-9-hydroperoxy-4,6-dihydroxy-6,9-dimethyl-3-methylidene-2-oxo-3a,4,5,6a,9a,9b-hexahydroazuleno[4,5-b]furan-5-yl] acetate

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Identifiers

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