BENZO(A)PYRENYL-9-GLUCURONIDE structure
|
Common Name | BENZO(A)PYRENYL-9-GLUCURONIDE | ||
|---|---|---|---|---|
| CAS Number | 60262-87-5 | Molecular Weight | 444.43300 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C26H20O7 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
| Name | (2S,3S,4S,5R)-6-benzo[a]pyren-9-yloxy-3,4,5-trihydroxyoxane-2-carboxylic acid |
|---|
| Molecular Formula | C26H20O7 |
|---|---|
| Molecular Weight | 444.43300 |
| Exact Mass | 444.12100 |
| PSA | 116.45000 |
| LogP | 3.00820 |
| InChIKey | XEDZOKHSJROQER-BFZHNPFYSA-N |
| SMILES | O=C(O)C1OC(Oc2ccc3cc4ccc5cccc6ccc(c3c2)c4c56)C(O)C(O)C1O |