Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C12H12 |
| Molecular Weight | 156.2237 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC1=CC2=CC=CC(C)=C2C=C1
InChI
InChIKey=CBMXCNPQDUJNHT-UHFFFAOYSA-N
InChI=1S/C12H12/c1-9-6-7-12-10(2)4-3-5-11(12)8-9/h3-8H,1-2H3
Approval Year
PubMed
| Title | Date | PubMed |
|---|---|---|
| Structure-activity relationships for a large diverse set of natural, synthetic, and environmental estrogens. | 2001 Mar |
|
| Predictive three-dimensional quantitative structure-activity relationship of cytochrome P450 1A2 inhibitors. | 2005 Jun 2 |
|
| Prediction of estrogen receptor agonists and characterization of associated molecular descriptors by statistical learning methods. | 2006 Nov |
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52966
Created by
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34065
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DTXSID7022415
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575-43-9
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209-385-1
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6024
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11328
Created by
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DXN13WI5EY
Created by
admin on Fri Dec 15 19:14:24 GMT 2023 , Edited by admin on Fri Dec 15 19:14:24 GMT 2023
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SUBSTANCE RECORD
