(Q105288204)

English

(3aS,5aR,8R,8aR,9aR)-8-hydroxy-8-methyl-1-methylidene-4,5,5a,6,7,8a,9,9a-octahydro-3aH-azuleno[6,5-b]furan-2-one

chemical compound

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instance of

type of chemical entity

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subclass of

8-hydroxy-8-methyl-1-methylidene-4,5,5a,6,7,8a,9,9a-octahydro-3aH-azuleno[6,5-b]furan-2-one

1 reference

based on heuristic

inferred from SMILES

(3aS,5aR,8R,8aR)-8-hydroxy-8-methyl-1-methylidene-4,5,5a,6,7,8a,9,9a-octahydro-3aH-azuleno[6,5-b]furan-2-one

1 reference

based on heuristic

inferred from SMILES

mass

236.1412445 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₄H₂₀O₃

0 references

canonical SMILES

O=C1OC2CCC3CCC(O)(C)C3CC2C1=C

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isomeric SMILES

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

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found in taxon

Inula anatolica

1 reference

stated in

Guaianolides from Inula anatolica

Identifiers

InChI

InChI=1S/C14H20O3/c1-8-10-7-11-9(5-6-14(11,2)16)3-4-12(10)17-13(8)15/h9-12,16H,1,3-7H2,2H3/t9-,10-,11-,12+,14-/m1/s1

0 references

InChIKey

VKYKPIJTOAOAIG-MPLKPFFPSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

VKYKPIJTOAOAIG-MPLKPFFPSA-N

(Q105288204)

(3aS,5aR,8R,8aR,9aR)-8-hydroxy-8-methyl-1-methylidene-4,5,5a,6,7,8a,9,9a-octahydro-3aH-azuleno[6,5-b]furan-2-one

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Identifiers

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