For research use only. Not for therapeutic Use.
Penimepicycline is an antibiotic. It is the phenoxymethylpenicillinate salt of the tetracycline antibiotic pipacycline
| Catalog Number | I034389 |
| CAS Number | 4599-60-4 |
| Synonyms | Penimepicycline; Hydrocycline; Duamine |
| Molecular Formula | C45H56N6O14S |
| Purity | 98% |
| Solubility | To be determined |
| Appearance | Solid powder |
| Storage | Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years). |
| IUPAC Name | (4S,4aS,5aS,6S,12aS)-4-(dimethylamino)-3,6,10,12,12a-pentahydroxy-N-((4-(2-hydroxyethyl)piperazin-1-yl)methyl)-6-methyl-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide (2S,5R,6R)-3,3-dimethyl-7-oxo-6-(2-phenoxyacetamido)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate |
| InChI | InChI=1S/C29H38N4O9.C16H18N2O5S/c1-28(41)15-5-4-6-18(35)19(15)23(36)20-16(28)13-17-22(31(2)3)24(37)21(26(39)29(17,42)25(20)38)27(40)30-14-33-9-7-32(8-10-33)11-12-34;1-16(2)12(15(21)22)18-13(20)11(14(18)24-16)17-10(19)8-23-9-6-4-3-5-7-9/h4-6,16-17,22,34-35,37-38,41-42H,7-14H2,1-3H3,(H,30,40);3-7,11-12,14H,8H2,1-2H3,(H,17,19)(H,21,22)/t16-,17-,22-,28+,29-;11-,12+,14-/m01/s1 |
| InChIKey | MEGKRPMNPGTIIG-VNYBMUHKSA-N |
| SMILES | CN([C@H]1[C@@H]2C[C@H]3C(C(c4c([C@]3(O)C)cccc4O)=O)=C([C@@]2(C(C(C(NCN5CCN(CC5)CCO)=O)=C1O)=O)O)O)C.CC6(S[C@@H]7[C@@H](C(N7[C@H]6C(O)=O)=O)NC(COc8ccccc8)=O)C |
