(Q104919430)

English

(3aS,7R,8aR)-7-methyl-3-methylidene-6-(3-oxobutyl)-4,7,8,8a-tetrahydro-3aH-cyclohepta[b]furan-2-one

chemical compound

In more languages

Statements

type of chemical entity

0 references

(7S,8aR)-7-methyl-3-methylidene-6-(3-oxobutyl)-4,7,8,8a-tetrahydro-3aH-cyclohepta[b]furan-2-one

1 reference

based on heuristic

inferred from SMILES

1 reference

based on heuristic

inferred from SMILES

(7S,8aS)-7-methyl-3-methylidene-6-(3-oxobutyl)-4,7,8,8a-tetrahydro-3aH-cyclohepta[b]furan-2-one

1 reference

based on heuristic

inferred from SMILES

8-epi-Tomentosin

1 reference

based on heuristic

inferred from SMILES

248.1412445 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(3aS,7S,8aS)-7-methyl-3-methylidene-6-(3-oxobutyl)-4,7,8,8a-tetrahydro-3aH-cyclohepta[b]furan-2-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

1 reference

based on heuristic

inferred from InChI

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₅H₂₀O₃

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canonical SMILES

O=C1OC2CC(C(=CCC2C1=C)CCC(=O)C)C

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isomeric SMILES

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

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Inula britannica

1 reference

Seven sesquiterpene lactones from Inula britannica var. chinensis

Pentanema britannicum

1 reference

Seven sesquiterpene lactones from Inula britannica var. chinensis

Identifiers

InChI=1S/C15H20O3/c1-9-8-14-13(11(3)15(17)18-14)7-6-12(9)5-4-10(2)16/h6,9,13-14H,3-5,7-8H2,1-2H3/t9-,13+,14-/m1/s1

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AVFIYMSJDDGDBQ-BIGNPOOSSA-N

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1 reference

17 September 2022

based on heuristic

inferred from InChIKey

UniChem compound ID

1 reference

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