Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C16H18O2 |
| Molecular Weight | 242.3129 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CCC(C)(C1=CC=C(O)C=C1)C2=CC=C(O)C=C2
InChI
InChIKey=HTVITOHKHWFJKO-UHFFFAOYSA-N
InChI=1S/C16H18O2/c1-3-16(2,12-4-8-14(17)9-5-12)13-6-10-15(18)11-7-13/h4-11,17-18H,3H2,1-2H3
| Molecular Formula | C16H18O2 |
| Molecular Weight | 242.3129 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
Approval Year
PubMed
| Title | Date | PubMed |
|---|---|---|
| Prediction of estrogen receptor agonists and characterization of associated molecular descriptors by statistical learning methods. | 2006 Nov |
|
| High content imaging-based assay to classify estrogen receptor-α ligands based on defined mechanistic outcomes. | 2011 May 15 |
|
| Defining estrogenic mechanisms of bisphenol A analogs through high throughput microscopy-based contextual assays. | 2014 Jun 19 |
Patents
| Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 17:39:17 GMT 2023
by
admin
on
Fri Dec 15 17:39:17 GMT 2023
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| Record UNII |
1RC731TJJA
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| Record Status |
Validated (UNII)
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| Record Version |
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66166
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DTXSID4022442
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C492482
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1RC731TJJA
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201-025-1
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8086
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m2569
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77-40-7
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