(Q105325430)

English

[(3S,3aR,4R,6E,10E,11aR)-3,6-dimethyl-2-oxo-3a,4,5,8,9,11a-hexahydro-3H-cyclodeca[b]furan-4-yl] 3-hydroxy-3-methylbutanoate

chemical compound

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instance of

type of chemical entity

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subclass of

(3,6-dimethyl-2-oxo-3a,4,5,8,9,11a-hexahydro-3H-cyclodeca[b]furan-4-yl) 3-hydroxy-3-methylbutanoate

1 reference

based on heuristic

inferred from SMILES

mass

336.193673996 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₉H₂₈O₅

0 references

canonical SMILES

O=C(OC1CC(=CCCC=CC2OC(=O)C(C)C21)C)CC(O)(C)C

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isomeric SMILES

C/C1=C\CC/C=C/[C@H]2OC(=O)[C@@H](C)[C@@H]2[C@H](OC(=O)CC(C)(C)O)C1

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found in taxon

Florestina tripteris

1 reference

stated in

Eupatolide and borneol derivatives from Florestina tripteris

Identifiers

InChI

InChI=1S/C19H28O5/c1-12-8-6-5-7-9-14-17(13(2)18(21)24-14)15(10-12)23-16(20)11-19(3,4)22/h7-9,13-15,17,22H,5-6,10-11H2,1-4H3/b9-7+,12-8+/t13-,14+,15+,17-/m0/s1

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InChIKey

XCUVROVGTPLMKE-HGBJFUDNSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

XCUVROVGTPLMKE-HGBJFUDNSA-N

(Q105325430)

[(3S,3aR,4R,6E,10E,11aR)-3,6-dimethyl-2-oxo-3a,4,5,8,9,11a-hexahydro-3H-cyclodeca[b]furan-4-yl] 3-hydroxy-3-methylbutanoate

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Identifiers

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