(Q105016560)

English

(3S,3aR,4S,7R,10E,11aR)-3a,4,5,6,7,8,9,11a-Octahydro-4,7-dihydroxy-3,10-dimethyl-6-methylenecyclodeca[b]furan-2(3H)-one

chemical compound

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Statements

instance of

type of chemical entity

0 references

1 reference

(3S,4S,7R,10E,11aR)-4,7-dihydroxy-3,10-dimethyl-6-methylidene-3,3a,4,5,7,8,9,11a-octahydrocyclodeca[b]furan-2-one

1 reference

based on heuristic

inferred from SMILES

4,7-Dihydroxy-3,10-dimethyl-6-methylidene-3,3a,4,5,7,8,9,11a-octahydrocyclodeca[b]furan-2-one

1 reference

based on heuristic

inferred from SMILES

mass

266.151809184 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(3R,3aS,4R,7R,10Z,11aS)-4,7-dihydroxy-3,10-dimethyl-6-methylidene-3,3a,4,5,7,8,9,11a-octahydrocyclodeca[b]furan-2-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(3R,3aS,4R,7R,11aS)-4,7-dihydroxy-3,10-dimethyl-6-methylidene-3,3a,4,5,7,8,9,11a-octahydrocyclodeca[b]furan-2-one

1 reference

based on heuristic

inferred from InChI

(3S,3aR,4S,7R,10E,11aS)-4,7-dihydroxy-3,10-dimethyl-6-methylidene-3,3a,4,5,7,8,9,11a-octahydrocyclodeca[b]furan-2-one

1 reference

based on heuristic

inferred from InChI

(3R,3aR,4S,7R,10E,11aR)-4,7-dihydroxy-3,10-dimethyl-6-methylidene-3,3a,4,5,7,8,9,11a-octahydrocyclodeca[b]furan-2-one

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₅H₂₂O₄

0 references

canonical SMILES

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

0 references

isomeric SMILES

C=C1C[C@H](O)[C@H]2[C@H](C)C(=O)O[C@@H]2/C=C(\C)CC[C@H]1O

0 references

found in taxon

Achillea atrata

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 caerulescens

1 reference

stated in

Sesquiterpene lactones from Artemisia caerulescens Subsp. gargantae

Artemisia gypsacea

1 reference

stated in

A melampolide and two dihydro artemorin derivatives from artemisia gypsacea

Artemisia inculta

1 reference

stated in

Sesquiterpene lactones from Artemisia inculta

Artemisia oliveriana

1 reference

stated in

A Melampolide from Artemisia oliveriana

Achillea multifida

1 reference

stated in

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

Artemisia fragrans

1 reference

stated in

A Melampolide from Artemisia oliveriana

Artemisia herba-alba

2 references

stated in

Eudesmanolides and other constituents from Artemisia herba-alba

stated in

Sesquiterpene lactones from Artemisia herba-alba subsp. Herba-alba

Achillea clusiana

1 reference

stated in

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

Artemisia sieberi

1 reference

stated in

A Melampolide from Artemisia oliveriana

Identifiers

InChI

InChI=1S/C15H22O4/c1-8-4-5-11(16)9(2)7-12(17)14-10(3)15(18)19-13(14)6-8/h6,10-14,16-17H,2,4-5,7H2,1,3H3/b8-6+/t10-,11+,12-,13+,14+/m0/s1

0 references

InChIKey

GRUOWKYRKACQKC-JKMWFJKESA-N

0 references

CAS Registry Number

97534-15-1

1 reference

stated in

CAS (formerly Chemical Abstracts Service)

25 January 2022

1 reference

17 September 2022

inferred from InChIKey

(Q105016560)

(3S,3aR,4S,7R,10E,11aR)-3a,4,5,6,7,8,9,11a-Octahydro-4,7-dihydroxy-3,10-dimethyl-6-methylenecyclodeca[b]furan-2(3H)-one

Statements

Identifiers

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