For research use only. Not for therapeutic Use.
| Catalog Number | M116162 |
| CAS Number | 139914-00-4 |
| Synonyms | cephalosporin mustard |
| Molecular Formula | C27H28Cl2N4O6S |
| Purity | ≥95% |
| Storage | Desiccate at -20C |
| IUPAC Name | (6R,7R)-3-[[4-[bis(2-chloroethyl)amino]phenyl]carbamoyloxymethyl]-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid |
| InChI | InChI=1S/C27H28Cl2N4O6S/c28-10-12-32(13-11-29)20-8-6-19(7-9-20)30-27(38)39-15-18-16-40-25-22(24(35)33(25)23(18)26(36)37)31-21(34)14-17-4-2-1-3-5-17/h1-9,22,25H,10-16H2,(H,30,38)(H,31,34)(H,36,37)/t22-,25-/m1/s1 |
| InChIKey | YPVMPWUFEGUJOE-RCZVLFRGSA-N |
| SMILES | C1C(=C(N2C(S1)C(C2=O)NC(=O)CC3=CC=CC=C3)C(=O)O)COC(=O)NC4=CC=C(C=C4)N(CCCl)CCCl |
