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(Q104936119)
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English
[(1R,2R,3S,6S)-3-benzoyloxy-2-hydroxy-7-oxabicyclo[4.1.0]hept-4-en-1-yl]methyl benzoate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
(4-Benzoyloxy-5-hydroxy-7-oxabicyclo[4.1.0]hept-2-en-6-yl)methyl benzoate
1 reference
based on heuristic
inferred from SMILES
(-)-Pipoxide
1 reference
based on heuristic
inferred from SMILES
mass
366.110338296
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
Pipoxide
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₁H₁₈O₆
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canonical SMILES
O=C(OCC12OC2C=CC(OC(=O)C=3C=CC=CC3)C1O)C=4C=CC=CC4
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isomeric SMILES
O=C(OC[C@]12O[C@H]1C=C[C@H](OC(=O)c1ccccc1)[C@H]2O)c1ccccc1
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found in taxon
Eria angustifolia
1 reference
stated in
Cyclohexane oxide derivatives from Kaempferia angustifolia and Kaempferia species
Kaempferia Angustifolia
1 reference
stated in
Cyclohexane oxide derivatives from Kaempferia angustifolia and Kaempferia species
Uvaria pandensis
1 reference
stated in
Two indolosesquiterpenes from Uvaria pandensis
Mycaranthes angustifolia
1 reference
stated in
Cyclohexane oxide derivatives from Kaempferia angustifolia and Kaempferia species
Pinalia angustifolia
1 reference
stated in
Cyclohexane oxide derivatives from Kaempferia angustifolia and Kaempferia species
Identifiers
InChI
InChI=1S/C21H18O6/c22-18-16(26-20(24)15-9-5-2-6-10-15)11-12-17-21(18,27-17)13-25-19(23)14-7-3-1-4-8-14/h1-12,16-18,22H,13H2/t16-,17-,18+,21-/m0/s1
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InChIKey
BHNSEWKVMCNSGO-UGNRZPKXSA-N
0 references
PubChem CID
14283282
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
BHNSEWKVMCNSGO-UGNRZPKXSA-N
DSSTox substance ID
DTXSID401334870
1 reference
matched by identifier from
InChIKey
InChIKey
BHNSEWKVMCNSGO-UGNRZPKXSA-N
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