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(Q105127661)
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English
3-[4-hydroxy-3-[(E)-4-hydroxy-3-methylbut-2-enyl]-5-(3-methylbut-2-enyl)phenyl]propanoic acid
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
318.183109312
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₉H₂₆O₄
0 references
canonical SMILES
O=C(O)CCC=1C=C(C(O)=C(C1)CC=C(C)CO)CC=C(C)C
0 references
isomeric SMILES
CC(C)=CCc1cc(CCC(=O)O)cc(C/C=C(\C)CO)c1O
1 reference
based on heuristic
inferred from InChI
found in taxon
Artemisia capillaris
2 references
stated in
Capillartemisin A and B, two new choleretic principles from Artemisiae Capillaris Herba
stated in
Vascular dilatory action of Artemisia capillaris bud extracts and their active constituent
Identifiers
InChI
InChI=1S/C19H26O4/c1-13(2)4-7-16-10-15(6-9-18(21)22)11-17(19(16)23)8-5-14(3)12-20/h4-5,10-11,20,23H,6-9,12H2,1-3H3,(H,21,22)/b14-5+
0 references
InChIKey
JGRRPNPEKNCQBH-LHHJGKSTSA-N
0 references
PubChem CID
5315670
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
JGRRPNPEKNCQBH-LHHJGKSTSA-N
UniChem compound ID
43080667
1 reference
stated in
UniChem
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