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(5R)-2-[(1Z)-2,4-Hexadiyne-1-ylidene]-1,6-dioxaspiro[4.4]nonane-3-ene
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
200.083729624
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(5S)-2-[(E)-2,4-Hexadiyne-1-ylidene]-1,6-dioxaspiro[4.4]nonane-3-ene
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(5S)-2-[(Z)-2,4-Hexadiyne-1-ylidene]-1,6-dioxaspiro[4.4]nonane-3-ene
1 reference
based on heuristic
inferred from InChI
(5R)-2-[(E)-2,4-Hexadiyne-1-ylidene]-1,6-dioxaspiro[4.4]nona-3-ene
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₃H₁₂O₂
0 references
canonical SMILES
C(C#CC)#CC=C1OC2(OCCC2)C=C1
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isomeric SMILES
CC#CC#C/C=C1/C=C[C@@]2(CCCO2)O1
0 references
found in taxon
Artemisia assoana
1 reference
stated in
Phenolic and acetylenic metabolites from Artemisia assoana
Artemisia pedemontana
1 reference
stated in
Phenolic and acetylenic metabolites from Artemisia assoana
Chrysanthemum indicum
1 reference
stated in
Medicinal flowers. II. Inhibitors of nitric oxide production and absolute stereostructures of five new germacrane-type sesquiterpenes, kikkanols D, D monoacetate, E, F, and F monoacetate from the flowers of Chrysanthemum indicum L
Chrysanthemum yoshinaganthum
1 reference
stated in
Constituents of the essential oils from three tetraploid species of Chrysanthemum
Chrysanthemum naktongense
1 reference
stated in
Dendrazawaynes A and B, antifungal polyacetylenes from Dendranthema zawadskii (Asteraceae).
Matricaria chamomilla
1 reference
stated in
STRUCTURAL ELUCIDATION OF BIOACTIVE PRINCIPLES IN FLORAL EXTRACTS OF GERMAN CHAMOMILLE (MATRICARIA RECUTITA L.)
Tanacetum parthenium
1 reference
stated in
A sesquiterpene coumarin ether from transformed roots of Tanacetum parthenium
Dendranthema indicum
1 reference
stated in
Medicinal flowers. II. Inhibitors of nitric oxide production and absolute stereostructures of five new germacrane-type sesquiterpenes, kikkanols D, D monoacetate, E, F, and F monoacetate from the flowers of Chrysanthemum indicum L
Chamomilla recutita
1 reference
stated in
STRUCTURAL ELUCIDATION OF BIOACTIVE PRINCIPLES IN FLORAL EXTRACTS OF GERMAN CHAMOMILLE (MATRICARIA RECUTITA L.)
Identifiers
InChI
InChI=1S/C13H12O2/c1-2-3-4-5-7-12-8-10-13(15-12)9-6-11-14-13/h7-8,10H,6,9,11H2,1H3/b12-7-/t13-/m1/s1
0 references
InChIKey
WTRXKCNFPMTAJV-FFXRNRBCSA-N
0 references
PubChem CID
76960595
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
WTRXKCNFPMTAJV-FFXRNRBCSA-N
UniChem compound ID
13901718
1 reference
stated in
UniChem
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