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Untitled Document
Untitled Document
Untitled Document
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calebin A
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| Chemical Formula |
: C21H20O7 |
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| IUPAC Name |
: (3E)-4-(4-hydroxy-3-methoxyphenyl)-2-oxobut-3-en-1-yl (2E)-3-(4-h?ydroxy-3-methoxyphenyl)prop-2-enoate |
| CAS Registry Number / CID |
: 637429 |
| SMILES Notation |
: COC1=C(C=CC(=C1)C=CC(=O)COC(=O)C=CC2=CC(=C(C=C2)O)OC)O |
| Molecular weight |
: 384.3793 [g/mol] |
| x log P |
: 2.83 |
| H Bond Donor |
: 2 |
| H Bond Acceptor |
: 7 |
Molecular Structure |
| Rotatable bond count |
: 9 |
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Biological Activities |
Drug likeness / ADMET
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Constituents
(Alphabetical order) |
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