Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C16H12O7 |
| Molecular Weight | 316.2623 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
COC1=C(OC2=C(C1=O)C(O)=CC(O)=C2)C3=CC=C(O)C(O)=C3
InChI
InChIKey=WEPBGSIAWZTEJR-UHFFFAOYSA-N
InChI=1S/C16H12O7/c1-22-16-14(21)13-11(20)5-8(17)6-12(13)23-15(16)7-2-3-9(18)10(19)4-7/h2-6,17-20H,1H3
| Molecular Formula | C16H12O7 |
| Molecular Weight | 316.2623 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 19:30:24 GMT 2025
by
admin
on
Mon Mar 31 19:30:24 GMT 2025
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| Record UNII |
7J92C373RH
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| Record Status |
Validated (UNII)
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| Record Version |
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DTXSID20164032
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5280681
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16860
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154016
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57928
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6052
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| Related Record | Type | Details | ||
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PARENT -> CONSTITUENT ALWAYS PRESENT |
The highest 3-MQ yield was obtained using ethanol in the extraction with a plant:solvent ratio of 1:15 (w/v) and 30-min extraction time. Isolating 3-MQ from the ethanol extract was successfully performed from the corresponding dry residue by normal phase column chromatography (CC). The younger leaves of the Dark variety, cultivated in vase and collected at night, showed the highest 3-MQ yield.
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