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(Q105290291)
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English
[(1R,2R)-1-hydroxy-1-(7-methoxy-2-oxochromen-8-yl)-3-methylbut-3-en-2-yl] acetate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
7-Methoxy-8-(2-acetoxy-1-hydroxy-3-methyl-3-butenyl)-2H-1-benzopyran-2-one
1 reference
based on heuristic
inferred from SMILES
mass
318.110338296
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
[(1R,2S)-1-hydroxy-1-(7-methoxy-2-oxochromen-8-yl)-3-methylbut-3-en-2-yl] acetate
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₁₇H₁₈O₆
0 references
canonical SMILES
O=C1OC2=C(C=C1)C=CC(OC)=C2C(O)C(OC(=O)C)C(=C)C
0 references
isomeric SMILES
C=C(C)[C@@H](OC(C)=O)[C@H](O)c1c(OC)ccc2ccc(=O)oc12
0 references
found in taxon
Murraya exotica
1 reference
stated in
Constituents of Murraya exotica L. Structure elucidation of new coumarins.
Murraya paniculata
1 reference
stated in
Constituents of Murraya exotica L. Structure elucidation of new coumarins.
Glycosmis pentaphylla
1 reference
stated in
Constituents of Murraya exotica L. Structure elucidation of new coumarins.
Aglaia odorata
1 reference
stated in
Constituents of Murraya exotica L. Structure elucidation of new coumarins.
Identifiers
InChI
InChI=1S/C17H18O6/c1-9(2)16(22-10(3)18)15(20)14-12(21-4)7-5-11-6-8-13(19)23-17(11)14/h5-8,15-16,20H,1H2,2-4H3/t15-,16-/m1/s1
0 references
InChIKey
VONHPDPSQNJJTD-HZPDHXFCSA-N
0 references
PubChem CID
13917400
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
VONHPDPSQNJJTD-HZPDHXFCSA-N
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