| Compound-ID | 22102 |
| Common Name | 7,8-Dihydro-7-hydroxy-8-S-glutathionyl-benzo[a]pyrene |
| InChI |
InChI=1S/C30H29N3O7S/c31-21(30(39)40)9-11-24(34)33-22(29(38)32-13-25(35)36)14-41-23-10-8-18-19-7-6-16-3-1-2-15-4-5-17(27(19)26(15)16)12-20(18)28(23)37/h1-8,10,12,21-23,28,37H,9,11,13-14,31H2,(H,32,38)(H,33,34)(H,35,36)(H,39,40)/t21-,22-,23?,28?/m0/s1
|
| SMILES |
NC(CCC(=O)NC(CSC1C=Cc2c3ccc5cccc4ccc(cc2(C1(O)))c3c45)C(=O)NCC(O)=O)C(O)=O
|
|
View all entries for compound: 7,8-Dihydro-7-hydroxy-8-S-glutathionyl-benzo[a]pyrene |