Dinklagin A
(2S)-2-(2,2-dimethylchromen-6-yl)-7-hydroxy-6-(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one
Also Known As: Dinklagin A|(2S)-2-(2,2-dimethylchromen-6-yl)-7-hydroxy-6-(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one|7-Hydroxy-6-prenyl-6'',6''-dimethylpyrano[2'',3'':4',3']flavanone|6-(3,3-dimethylallyl)-7-hydroxy-6''', 6'''-dimethylchromeno-(4',3',2''',3''')-flavanone|(-)-6-(3,3-Dimethylallyl)-7-hydroxy-6''', 6'''-dimethylchromeno-(4',3',2''',3''')-flavanone|7-Hydroxy-6-prenyl-6'',6''-dimethylpyrano(2'',3'':4',3')flavanone|(2S)-7-Hydroxy-2',2'-dimethyl-6-(3-methylbut-2-en-1-yl)-2,3-dihydro-2'H,4H-[2,6'-bi-1-benzopyran]-4-one|7-Hydroxy-2',2'-dimethyl-6-(3-methylbut-2-en-1-yl)-2,3-dihydro-2'H,4H-[2,6'-bi-1-benzopyran]-4-one
| Molecular Formula | C25H26O4 |
|---|---|
| Molecular Weight | 390.1831 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 390.1831 |
| Monoisotopic Mass | 390.1831 |
| Heavy Atoms | 29 |
| Complexity | 674.0 |
Chemical Identifiers
| CAS Number | 487010-46-8 |
|---|---|
| SMILES | CC(=CCC1=CC2=C(C=C1O)O[C@@H](CC2=O)C3=CC4=C(C=C3)OC(C=C4)(C)C)C |
| InChIKey | XPMXYEFQBQWMEC-QHCPKHFHSA-N |
Product Overview
Dinklagin A (CAS 487010-46-8), with molecular formula C25H26O4 and molecular weight 390.1831 g/mol. IUPAC: (2S)-2-(2,2-dimethylchromen-6-yl)-7-hydroxy-6-(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one.
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