rac Samidin
(10-acetyloxy-8,8-dimethyl-2-oxo-9,10-dihydropyrano[2,3-f]chromen-9-yl) 3-methylbut-2-enoate
| Molecular Formula | C21H22O7 |
|---|---|
| Molecular Weight | 386.4 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 88.1 A2 |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 386.13657 |
| Heavy Atoms | 28 |
| Complexity | 716.0 |
Chemical Identifiers
| CAS Number | 95042-85-6 |
|---|---|
| SMILES | CC(=CC(=O)OC1C(C2=C(C=CC3=C2OC(=O)C=C3)OC1(C)C)OC(=O)C)C |
| InChIKey | FNVCLGWRMXTDSM-UHFFFAOYSA-N |
📖 Product Overview
rac Samidin (CAS: 95042-85-6) is a chemical compound with molecular formula C21H22O7 and molecular weight 386.4 g/mol. Its IUPAC systematic name is (10-acetyloxy-8,8-dimethyl-2-oxo-9,10-dihydropyrano[2,3-f]chromen-9-yl) 3-methylbut-2-enoate.
FNVCLGWRMXTDSM-UHFFFAOYSA-N.
SMILES: CC(=CC(=O)OC1C(C2=C(C=CC3=C2OC(=O)C=C3)OC1(C)C)OC(=O)C)C.
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