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(Q105265646)
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English
2-[(2R,4aR,8R,8aS)-4a-methylspiro[1,2,3,4,5,6,7,8a-octahydronaphthalene-8,2'-oxirane]-2-yl]prop-2-enoic acid
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
2-{4a-methyl-octahydrospiro[naphthalene-1,2'-oxiran]-7-yl}prop-2-enoic acid
1 reference
based on heuristic
inferred from SMILES
mass
250.156894564
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₅H₂₂O₃
0 references
canonical SMILES
O=C(O)C(=C)C1CCC2(C)CCCC3(OC3)C2C1
0 references
isomeric SMILES
C=C(C(=O)O)[C@@H]1CC[C@@]2(C)CCC[C@]3(CO3)[C@H]2C1
0 references
found in taxon
Apalochlamys spectabilis
1 reference
stated in
Eudesmane derivatives other constituents fromApalochlamys spectabilis Cassinia species
Identifiers
InChI
InChI=1S/C15H22O3/c1-10(13(16)17)11-4-7-14(2)5-3-6-15(9-18-15)12(14)8-11/h11-12H,1,3-9H2,2H3,(H,16,17)/t11-,12+,14-,15+/m1/s1
0 references
InChIKey
TVYXUUYVDLOJNA-OSRDXIQISA-N
0 references
PubChem CID
163193454
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
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