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(Q105006794)
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English
8-[(1S,2S)-1-ethoxy-2-hydroxy-3-methylbut-3-enyl]-7-methoxychromen-2-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
biogenic coumarin
0 references
mass
304.13107374
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
8-[(1R,2S)-1-ethoxy-2-hydroxy-3-methylbut-3-enyl]-7-methoxychromen-2-one
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₇H₂₀O₅
0 references
canonical SMILES
O=C1OC2=C(C=C1)C=CC(OC)=C2C(OCC)C(O)C(=C)C
0 references
isomeric SMILES
C=C(C)[C@H](O)[C@@H](OCC)c1c(OC)ccc2ccc(=O)oc12
0 references
found in taxon
Murraya exotica
1 reference
stated in
A cinnamic acid derivative and a coumarin from Murraya exotica
Murraya paniculata
2 references
stated in
A cinnamic acid derivative and a coumarin from Murraya exotica
stated in
Constituents of Flowers ofMurraya Paniculata
Glycosmis pentaphylla
1 reference
stated in
A cinnamic acid derivative and a coumarin from Murraya exotica
Aglaia odorata
1 reference
stated in
A cinnamic acid derivative and a coumarin from Murraya exotica
Identifiers
InChI
InChI=1S/C17H20O5/c1-5-21-17(15(19)10(2)3)14-12(20-4)8-6-11-7-9-13(18)22-16(11)14/h6-9,15,17,19H,2,5H2,1,3-4H3/t15-,17-/m0/s1
0 references
InChIKey
GDLSTIJVZWVVPB-RDJZCZTQSA-N
0 references
PubChem CID
92154813
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
GDLSTIJVZWVVPB-RDJZCZTQSA-N
UniChem compound ID
14077002
1 reference
stated in
UniChem
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