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(Q105237110)
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English
3-O-Angeloylplucheinol
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
1-hydroxy-7-(2-hydroxypropan-2-yl)-1,4a-dimethyl-6-oxo-3,4,5,8a-tetrahydro-2H-naphthalen-2-yl 2-methylbut-2-enoate
1 reference
based on heuristic
inferred from SMILES
mass
350.20932406
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
4aalpha,5,6,7,8,8a-Hexahydro-5alpha-hydroxy-3-(1-hydroxy-1-methylethyl)-5,8abeta-dimethyl-6beta-(angeloyloxy)naphthalen-2(1H)-one
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₀H₃₀O₅
0 references
canonical SMILES
O=C(OC1CCC2(C)CC(=O)C(=CC2C1(O)C)C(O)(C)C)C(=CC)C
0 references
isomeric SMILES
C/C=C(/C)C(=O)O[C@@H]1CC[C@]2(C)CC(=O)C(C(C)(C)O)=C[C@H]2[C@]1(C)O
0 references
found in taxon
Epaltes mexicana
2 references
stated in
Sesquiterpenes with antibacterial activity from Epaltes mexicana
stated in
Eudesmane derivatives from Epaltes mexicana
Neurolaena lobata
1 reference
stated in
Cuauthemone derivatives from Tessaria integrifolia and Pluchea symphytifolia
Identifiers
InChI
InChI=1S/C20H30O5/c1-7-12(2)17(22)25-16-8-9-19(5)11-14(21)13(18(3,4)23)10-15(19)20(16,6)24/h7,10,15-16,23-24H,8-9,11H2,1-6H3/b12-7-/t15-,16-,19-,20+/m1/s1
0 references
InChIKey
RISVCAJZZKFUCL-KOWWWBHVSA-N
0 references
PubChem CID
9998025
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
32874833
1 reference
stated in
UniChem
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