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(Q104996443)
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English
2-[(1R,2S)-1-(carboxymethyl)-5-ethenyl-7-hydroxy-1,6-dimethyl-3,4-dihydro-2H-naphthalen-2-yl]-2-methylpropanoic acid
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
2-[1-(carboxymethyl)-5-ethenyl-7-hydroxy-1,6-dimethyl-3,4-dihydro-2H-naphthalen-2-yl]-2-methylpropanoic acid
1 reference
based on heuristic
inferred from SMILES
mass
346.178023932
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₂₆O₅
0 references
canonical SMILES
O=C(O)CC1(C2=CC(O)=C(C(C=C)=C2CCC1C(C(=O)O)(C)C)C)C
0 references
isomeric SMILES
C=Cc1c(C)c(O)cc2c1CC[C@H](C(C)(C)C(=O)O)[C@@]2(C)CC(=O)O
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found in taxon
Elateriospermum tapos
1 reference
stated in
Seco-terpenoids and other constituents from Elateriospermum tapos
Identifiers
InChI
InChI=1S/C20H26O5/c1-6-12-11(2)15(21)9-14-13(12)7-8-16(19(3,4)18(24)25)20(14,5)10-17(22)23/h6,9,16,21H,1,7-8,10H2,2-5H3,(H,22,23)(H,24,25)/t16-,20+/m1/s1
0 references
InChIKey
FJZVRPIMSAZTOY-UZLBHIALSA-N
0 references
PubChem CID
162970036
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
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