Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C29H44O2 |
| Molecular Weight | 424.6585 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC(C)(C)C1=CC(CC2=CC(=C(O)C(=C2)C(C)(C)C)C(C)(C)C)=CC(=C1O)C(C)(C)C
InChI
InChIKey=MDWVSAYEQPLWMX-UHFFFAOYSA-N
InChI=1S/C29H44O2/c1-26(2,3)20-14-18(15-21(24(20)30)27(4,5)6)13-19-16-22(28(7,8)9)25(31)23(17-19)29(10,11)12/h14-17,30-31H,13H2,1-12H3
Approval Year
PubMed
| Title | Date | PubMed |
|---|---|---|
| Structure-activity relationships for a large diverse set of natural, synthetic, and environmental estrogens. | 2001 Mar |
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| Antioxidant activity of o-bisphenols: the role of intramolecular hydrogen bonding. | 2003 Jun 27 |
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| Prediction of estrogen receptor agonists and characterization of associated molecular descriptors by statistical learning methods. | 2006 Nov |
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204-279-1
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118-82-1
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8372
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30551
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DTXSID7022411
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37N5K66648
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SUBSTANCE RECORD
