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Untitled Document
Untitled Document
Untitled Document
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methylzedoarondiol
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Chemical Formula |
: C16H26O3 |
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IUPAC Name |
: (1S,3aR,4R,8aS)-1-hydroxy-4-methoxy-1,4-dimethyl-7-(propan-2-ylid?ene)octahydroazulen-6(1H)-one |
CAS Registry Number / CID |
: 10251993 |
SMILES Notation |
: C/C(C)=C1/C[C@@H]2[C@@](C)(O)CC[C@H]2[C@@](C)(CC1=O)OC |
Molecular weight |
: 266.3758[g/mol] |
x log P |
: 1.34 |
H Bond Donor |
: 1 |
H Bond Acceptor |
: 3 |
Molecular Structure |
Rotatable bond count |
: 2 |
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Biological Activities |
Drug likeness / ADMET
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Constituents
(Alphabetical order) |
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