(Q105201830)

English

[(3aR,4R,6E,10E,11aS)-6,10-dimethyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] (2S,3R)-2,3-dimethyloxirane-2-carboxylate

chemical compound

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instance of

type of chemical entity

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subclass of

(6,10-Dimethyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl) 2,3-dimethyloxirane-2-carboxylate

1 reference

based on heuristic

inferred from SMILES

mass

346.178023932 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₂₆O₅

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canonical SMILES

O=C1OC2C=C(C)CCC=C(C)CC(OC(=O)C3(OC3C)C)C2C1=C

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isomeric SMILES

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

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found in taxon

Ursinia anthemoides

1 reference

stated in

Sesquiterpene lactones and other constituents from Ursinia species

Identifiers

InChI

InChI=1S/C20H26O5/c1-11-7-6-8-12(2)10-16(24-19(22)20(5)14(4)25-20)17-13(3)18(21)23-15(17)9-11/h8-9,14-17H,3,6-7,10H2,1-2,4-5H3/b11-9+,12-8+/t14-,15+,16-,17+,20+/m1/s1

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InChIKey

OWAUPJWPBXIMAJ-FFSKOBAQSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

OWAUPJWPBXIMAJ-FFSKOBAQSA-N

(Q105201830)

[(3aR,4R,6E,10E,11aS)-6,10-dimethyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] (2S,3R)-2,3-dimethyloxirane-2-carboxylate

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Identifiers

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