Identification
| Name |
(4S,5S)-9-Methoxy-4,5-dihydrobenzo[pqr]tetraphene-4,5-diol |
| Synonyms |
9-Mdd-benzo(a)pyrene; 9-Methoxy-4,5-dihydrobenzo(a)pyrene-4,5-diol; 9-methoxy-4,5-dihydroxy-4,5-dihydrobenzo(a)pyrene |
|
| Molecular Structure |
![CAS#: 87771-55-9, (4S,5S)-9-Methoxy-4,5-dihydrobenzo[pqr]tetraphene-4,5-diol](/moreStructures/87771-55-9.gif) |
| Molecular Formula |
C21H16O3 |
| Molecular Weight |
316.35 |
| CAS Registry Number |
87771-55-9 |
| SMILES |
O(c1cc2c(cc1)cc5c3c4c(ccc23)cccc4[C@H](O)[C@H]5O)C |
| InChI |
1S/C21H16O3/c1-24-13-7-5-12-9-17-19-14(16(12)10-13)8-6-11-3-2-4-15(18(11)19)20(22)21(17)23/h2-10,20-23H,1H3/t20-,21-/m0/s1 |
| InChIKey |
INBRASMQRHSCFN-SFTDATJTSA-N |
|