Daphnodorin A
[(2S)-5-hydroxy-2,8-bis(4-hydroxyphenyl)-3,4-dihydro-2H-furo[2,3-h]chromen-9-yl]-(2,4,6-trihydroxyphenyl)methanone
| Molecular Formula | C30H22O9 |
|---|---|
| Molecular Weight | 526.5 g/mol |
| LogP | 5.6 |
| Topological Polar Surface Area | 161.0 A2 |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 526.1264 |
| Heavy Atoms | 39 |
| Complexity | 841.0 |
Chemical Identifiers
| CAS Number | 95733-03-2 |
|---|---|
| SMILES | C1CC2=C(C3=C(C=C2O)OC(=C3C(=O)C4=C(C=C(C=C4O)O)O)C5=CC=C(C=C5)O)OC1C6=CC=C(C=C6)O |
| InChIKey | SFIBBWQCUADULX-QHCPKHFHSA-N |
📖 Product Overview
Daphnodorin A (CAS: 95733-03-2) is a chemical compound with molecular formula C30H22O9 and molecular weight 526.5 g/mol. Its IUPAC systematic name is [(2S)-5-hydroxy-2,8-bis(4-hydroxyphenyl)-3,4-dihydro-2H-furo[2,3-h]chromen-9-yl]-(2,4,6-trihydroxyphenyl)methanone.
SFIBBWQCUADULX-QHCPKHFHSA-N.
SMILES: C1CC2=C(C3=C(C=C2O)OC(=C3C(=O)C4=C(C=C(C=C4O)O)O)C5=CC=C(C=C5)O)OC1C6=CC=C(C=C6)O.
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