Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA012040
PROPERTIES
| NPAID | NPA012040 |
|---|---|
| CLUSTER ID | 307 |
| NODE ID | 279 |
| NAME | 3-Propionyl-4""-butyryltylosin |
| FORMULA | C53H87NO19 |
| MOLECULAR WEIGHT (Da) | 1042.2670 |
| ACCURATE MASS (Da) | 1041.5872 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | thermotolerans ATCC 11416 |
| InChIKey | VHXRQUFBGZHQFX-GGFUBXOKSA-N |
| InChI | InChI=1S/C53H87NO19/c1-15-18-40(58)71-50-33(9)66-42(26-53(50,10)62)72-47-32(8)68-51(45(61)43(47)54(11)12)73-46-30(6)38(70-39(57)17-3)25-41(59)69-37(16-2)35(23-28(4)19-20-36(56)29(5)24-34(46)21-22-55)27-65-52-49(64-14)48(63-13)44(60)31(7)67-52/h19-20,22-23,29-35,37-38,42-52,60-62H,15-18,21,24-27H2,1-14H3/b20-19-,28-23-/t29-,30+,31?,32?,33?,34+,35?,37+,38-,42?,43?,44?,45?,46-,47?,48?,49?,50?,51?,52?,53?/m1/s1 |
| SMILES | CCCC(=O)OC1C(OC(CC1(C)O)OC2C(OC(C(C2N(C)C)O)O[C@@H]3[C@H]([C@@H](CC(=O)O[C@H](C(/C=C(\C=C/C(=O)[C@@H](C[C@@H]3CC=O)C)/C)COC4C(C(C(C(O4)C)O)OC)OC)CC)OC(=O)CC)C)C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Okamoto, R; Nomura, H; Tsuchiya, M; Tsunekawa, H; Fukumoto, T; Inui, T; Sawa, T; Takeuchi, T; Umezawa, H The activity of 4''-acylated tylosin derivatives against macrolide-resistant gram-positive bacteria Journal of Antibiotics 1979 32 (5) 542-544. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.32.542 | PMID | 528400 |
