(Q105266972)

English

(3S,3aR,4S,6E,10E,11aR)-4-hydroxy-3,6,10-trimethyl-3a,4,5,8,9,11a-hexahydro-3H-cyclodeca[b]furan-2-one

chemical compound

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instance of

type of chemical entity

0 references

subclass of

4-hydroxy-3,6,10-trimethyl-3a,4,5,8,9,11a-hexahydro-3H-cyclodeca[b]furan-2-one

1 reference

based on heuristic

inferred from SMILES

mass

250.156894564 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(3R,3aR,4S,11aR)-4-hydroxy-3,6,10-trimethyl-3a,4,5,8,9,11a-hexahydro-3H-cyclodeca[b]furan-2-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(3S,3aR,4R,6Z,10Z,11aS)-4-hydroxy-3,6,10-trimethyl-3a,4,5,8,9,11a-hexahydro-3H-cyclodeca[b]furan-2-one

2 references

based on heuristic

inferred from InChIKey

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

(3R,3aR,4R,6E,10E,11aS)-4-hydroxy-3,6,10-trimethyl-3a,4,5,8,9,11a-hexahydro-3H-cyclodeca[b]furan-2-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(3S,3aR,4S,6Z,10E,11aS)-4-hydroxy-3,6,10-trimethyl-3a,4,5,8,9,11a-hexahydro-3H-cyclodeca[b]furan-2-one

1 reference

based on heuristic

inferred from InChI

(3R,3aS,4S,6E,10E,11aR)-4-hydroxy-3,6,10-trimethyl-3a,4,5,8,9,11a-hexahydro-3H-cyclodeca[b]furan-2-one

1 reference

based on heuristic

inferred from InChI

(3R,3aR,4R,6E,10E,11aR)-4-hydroxy-3,6,10-trimethyl-3a,4,5,8,9,11a-hexahydro-3H-cyclodeca[b]furan-2-one

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₅H₂₂O₃

0 references

canonical SMILES

O=C1OC2C=C(C)CCC=C(C)CC(O)C2C1C

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isomeric SMILES

C/C1=C\[C@H]2OC(=O)[C@@H](C)[C@@H]2[C@@H](O)C/C(C)=C/CC1

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found in taxon

Achillea atrata

1 reference

stated in

Flavones and sesquiterpene lactones from Achillea atrata subsp. multifida: antimicrobial activity

Achillea multifida

1 reference

stated in

Flavones and sesquiterpene lactones from Achillea atrata subsp. multifida: antimicrobial activity

Artemisia barrelieri

1 reference

stated in

Sesquiterpene lactones fromArtemisia barrelieri

Artemisia inculta

1 reference

stated in

Sesquiterpene lactones from Artemisia inculta

Mikania pohlii

1 reference

stated in

A dimeric germacranolide and other sesquiterpene lactones from Mikania species

Tanacetopsis mucronata

1 reference

stated in

Mucronin ? A new germacranolide fromTanacetopsis mucronata

Achillea clusiana

1 reference

stated in

Flavones and sesquiterpene lactones from Achillea atrata subsp. multifida: antimicrobial activity

Identifiers

InChI

InChI=1S/C15H22O3/c1-9-5-4-6-10(2)8-13-14(12(16)7-9)11(3)15(17)18-13/h5,8,11-14,16H,4,6-7H2,1-3H3/b9-5+,10-8+/t11-,12-,13+,14+/m0/s1

0 references

InChIKey

TXSIFZZILWRCIY-VLUUFLOMSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

TXSIFZZILWRCIY-VLUUFLOMSA-N

1 reference

(Q105266972)

(3S,3aR,4S,6E,10E,11aR)-4-hydroxy-3,6,10-trimethyl-3a,4,5,8,9,11a-hexahydro-3H-cyclodeca[b]furan-2-one

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