| CAS Number | 79039-56-8 |
| Catalog Number | AG005CD0(AGN-PC-0UE3CC) |
| Chemical Name | 25-Desacetyl Rifapentin |
| IUPAC Name | (7S,9E,11S,12S,13S,14R,15R,16R,17S,18S,19E,21Z)-26-[(4-cyclopentylpiperazin-1-yl)iminomethyl]-2,13,15,17,27,29-hexahydroxy-11-methoxy-3,7,12,14,16,18,22-heptamethyl-8,30-dioxa-24-azatetracyclo[23.3.1.14,7.05,28]triaconta-1(29),2,4,9,19,21,25,27-octaene-6,23-dione |
| InChI | InChI=1S/C45H62N4O11/c1-23-12-11-13-24(2)44(57)47-35-30(22-46-49-19-17-48(18-20-49)29-14-9-10-15-29)40(54)32-33(41(35)55)39(53)28(6)42-34(32)43(56)45(7,60-42)59-21-16-31(58-8)25(3)37(51)27(5)38(52)26(4)36(23)50/h11-13,16,21-23,25-27,29,31,36-38,50-55H,9-10,14-15,17-20H2,1-8H3,(H,47,57)/b12-11+,21-16+,24-13-,46-22?/t23-,25+,26+,27-,31-,36-,37+,38+,45-/m0/s1 |
| InChI Key | LPUNEQQTZOWCNO-AMEVKTJQSA-N |
| MDL Number | MFCD08063718 |
| Molecular Formula | C45H62N4O11 |
| Molecular Weight | 834.9940 |
| SMILES | CO[C@H]1C=COC2(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](O)[C@@H](C)[C@H](O)[C@@H]1C)C)c(C=NN5CCN(CC5)C6CCCC6)c(O)c4c3C2=O |
| Synonyms | 25-Desacetyl Rifapentin,
25-DEACETYLRIFAPENTINE,
79039-56-8,
L 14583,
3-[[(4-Cyclopentyl-1-piperazinyl)imino]methyl]-25-O-deacetyl-rifamycin,
25-Desacetylrifapentine,
UNII-29A0K44SJO,
C45H62N4O11,
C45-H62-N4-O11,
L-14583,
|