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(Q105312822)
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English
methyl (3S)-3-hydroxy-2,2-dimethyl-3,4-dihydrochromene-6-carboxylate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
3,4-Dihydro-2,2-dimethyl-3-hydroxy-2H-1-benzopyran-6-carboxylic acid methyl ester
1 reference
based on heuristic
inferred from SMILES
mass
236.104858992
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₃H₁₆O₄
0 references
canonical SMILES
O=C(OC)C1=CC=C2OC(C)(C)C(O)CC2=C1
0 references
isomeric SMILES
COC(=O)c1ccc2c(c1)C[C@H](O)C(C)(C)O2
0 references
found in taxon
Piper dilatatum
1 reference
stated in
Antifungal benzoic acid derivatives from Piper Dilatatum in honour of Professor G. H. Neil Towers 75th birthday
Identifiers
InChI
InChI=1S/C13H16O4/c1-13(2)11(14)7-9-6-8(12(15)16-3)4-5-10(9)17-13/h4-6,11,14H,7H2,1-3H3/t11-/m0/s1
0 references
InChIKey
WTVSCXNJRUXNLO-NSHDSACASA-N
0 references
PubChem CID
144805127
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
WTVSCXNJRUXNLO-NSHDSACASA-N
UniChem compound ID
153171405
1 reference
stated in
UniChem
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