(Q105217625)

English

[(3aS,4R,5E,9R,10Z,11aS)-9-hydroxy-6,10-dimethyl-3-methylidene-2-oxo-3a,4,7,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] acetate

chemical compound

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instance of

type of chemical entity

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subclass of

(9-Hydroxy-6,10-dimethyl-3-methylidene-2-oxo-3a,4,7,8,9,11a-hexahydrocyclodeca[b]furan-4-yl) acetate

1 reference

based on heuristic

inferred from SMILES

mass

306.146723804 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

[(3aS,4R,5E,9R,10E,11aS)-9-hydroxy-6,10-dimethyl-3-methylidene-2-oxo-3a,4,7,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] acetate

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

[(3aS,4S,5E,9R,10Z,11aR)-9-hydroxy-6,10-dimethyl-3-methylidene-2-oxo-3a,4,7,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] acetate

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₇H₂₂O₅

0 references

canonical SMILES

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

0 references

isomeric SMILES

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

0 references

found in taxon

Liriodendron tulipifera

1 reference

stated in

Tulirinol, an antifeedant sesquiterpene lactone for the gypsy moth larvae from Liriodendron tulipifera

Identifiers

InChI

InChI=1S/C17H22O5/c1-9-5-6-13(19)10(2)8-15-16(11(3)17(20)22-15)14(7-9)21-12(4)18/h7-8,13-16,19H,3,5-6H2,1-2,4H3/b9-7+,10-8-/t13-,14-,15+,16+/m1/s1

0 references

InChIKey

QAUJITGGHQZVFF-YJLFHNJSSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

QAUJITGGHQZVFF-YJLFHNJSSA-N

(Q105217625)

[(3aS,4R,5E,9R,10Z,11aS)-9-hydroxy-6,10-dimethyl-3-methylidene-2-oxo-3a,4,7,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] acetate

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