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(Q104402825)
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Spiciformin
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
Speciformin
1 reference
based on heuristic
inferred from SMILES
2-Hydroxy-5,9-dimethyl-14-methylidene-4,12-dioxatricyclo[9.3.0.03,5]tetradec-8-en-13-one
1 reference
based on heuristic
inferred from SMILES
mass
264.13615912
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(1S,2S,3R,5R,8E,11S)-2-hydroxy-5,9-dimethyl-14-methylidene-4,12-dioxatricyclo[9.3.0.03,5]tetradec-8-en-13-one
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(1S,2S,3S,5R,8E,11S)-2-hydroxy-5,9-dimethyl-14-methylidene-4,12-dioxatricyclo[9.3.0.03,5]tetradec-8-en-13-one
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(1S,2R,3S,5S,8E,11S)-2-hydroxy-5,9-dimethyl-14-methylidene-4,12-dioxatricyclo[9.3.0.03,5]tetradec-8-en-13-one
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
Simsiolide
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(1S,2S,3S,5S,8E,11S)-2-hydroxy-5,9-dimethyl-14-methylidene-4,12-dioxatricyclo[9.3.0.03,5]tetradec-8-en-13-one
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(1R,2R,3S,5R,8E,11R)-2-hydroxy-5,9-dimethyl-14-methylidene-4,12-dioxatricyclo[9.3.0.03,5]tetradec-8-en-13-one
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
Isospeciformin
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(1R,2S,3S,5R,8E,11S)-2-hydroxy-5,9-dimethyl-14-methylidene-4,12-dioxatricyclo[9.3.0.03,5]tetradec-8-en-13-one
1 reference
based on heuristic
inferred from InChI
(1S,2S,3S,5R,8E,11R)-2-hydroxy-5,9-dimethyl-14-methylidene-4,12-dioxatricyclo[9.3.0.03,5]tetradec-8-en-13-one
1 reference
based on heuristic
inferred from InChI
(1S,2S,3R,5S,8E,11S)-2-hydroxy-5,9-dimethyl-14-methylidene-4,12-dioxatricyclo[9.3.0.03,5]tetradec-8-en-13-one
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₅H₂₀O₄
0 references
canonical SMILES
O=C1OC2CC(=CCCC3(OC3C(O)C2C1=C)C)C
0 references
isomeric SMILES
C=C1C(=O)O[C@H]2C/C(C)=C\CC[C@]3(C)O[C@@H]3[C@@H](O)[C@H]12
0 references
found in taxon
Tanacetum chiliophyllum
1 reference
stated in
Sesquiterpenes of Tanacetum chiliophyllum var. Heimerlei
Tanacetum argenteum
2 references
stated in
Sesquiterpene lactones from Tanacetum argenteum
stated in
A guaianolide from Tanacetum argenteum subsp. flabellifolium
Tanacetum densum
1 reference
stated in
Constituents of Tanacetum densum subsp. Eginense
Gonospermum canariense
1 reference
stated in
Sesquiterpene lactones and other constituents of Gonospermum canariense
Gonospermum elegans
1 reference
stated in
Sesquiterpenoid derivatives from Gonospermum elegans and their cytotoxic activity for HL-60 human promyelocytic cells.
Santolina rosmarinifolia
1 reference
stated in
Germacranolides from Santolina rosmarinifolia subsp. Canescens
Artemisia tridentata
1 reference
stated in
Sesquiterpene lactones of Artemisia arbuscula and A. tridentata
Tanacetum aureum
1 reference
stated in
Sesquiterpenes of Tanacetum chiliophyllum var. Heimerlei
Gonospermum ferulaceum
1 reference
stated in
Sesquiterpene lactones from Tanacetum ferulaceum
Identifiers
InChI
InChI=1S/C15H20O4/c1-8-5-4-6-15(3)13(19-15)12(16)11-9(2)14(17)18-10(11)7-8/h5,10-13,16H,2,4,6-7H2,1,3H3/b8-5-/t10-,11+,12-,13+,15-/m0/s1
0 references
InChIKey
ZMFCIMWRPFSUCY-RNQZZBDRSA-N
0 references
PubChem CID
101316855
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
ZMFCIMWRPFSUCY-RNQZZBDRSA-N
UniChem compound ID
97752679
1 reference
stated in
UniChem
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