| CAS Number | 1416773-23-3 |
| Catalog Number | AG009E5Y(AGN-PC-0WOZ77) |
| Chemical Name | 25-Deacetyl-23-acetyl Rifampicin (>85%) |
| IUPAC Name | [(7S,11S,12S,13R,14S,15R,16R,17S,18S)-2,13,17,27,29-pentahydroxy-11-methoxy-3,7,12,14,16,18,22-heptamethyl-26-[(E)-(4-methylpiperazin-1-yl)iminomethyl]-6,23-dioxo-8,30-dioxa-24-azatetracyclo[23.3.1.14,7.05,28]triaconta-1(29),2,4,9,19,21,25,27-octaen-15-yl] acetate |
| InChI | InChI=1S/C43H58N4O12/c1-21-12-11-13-22(2)42(55)45-33-28(20-44-47-17-15-46(9)16-18-47)37(52)30-31(38(33)53)36(51)26(6)40-32(30)41(54)43(8,59-40)57-19-14-29(56-10)23(3)35(50)25(5)39(58-27(7)48)24(4)34(21)49/h11-14,19-21,23-25,29,34-35,39,49-53H,15-18H2,1-10H3,(H,45,55)/b12-11?,19-14?,22-13?,44-20+/t21-,23+,24+,25-,29-,34-,35+,39+,43-/m0/s1 |
| InChI Key | LIHVNNJVNAODFP-BKPSJPIVSA-N |
| Molecular Formula | C43H58N4O12 |
| Molecular Weight | 822.9402 |
| SMILES | CO[C@H]1C=CO[C@@]2(C)Oc3c(C)c(O)c4c(O)c(NC(=O)C(=C/C=C/[C@H](C)[C@H](O)[C@@H](C)[C@@H](OC(=O)C)[C@@H](C)[C@H](O)[C@@H]1C)C)c(C=NN5CCN(C)CC5)c(O)c4c3C2=O |
| Synonyms | |