Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA007626
PROPERTIES
| NPAID | NPA007626 |
|---|---|
| CLUSTER ID | 653 |
| NODE ID | 579 |
| NAME | Moenomycin |
| FORMULA | C69H108N5O34P |
| MOLECULAR WEIGHT (Da) | 1582.5980 |
| ACCURATE MASS (Da) | 1581.6613 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | ghanaensis ATCC 14672 |
| InChIKey | CWWXIJNUPCBGQG-HWQYKPDZSA-N |
| InChI | InChI=1S/C69H108N5O34P/c1-30(2)15-14-17-31(3)18-19-33(5)22-25-68(9,10)24-13-12-16-32(4)23-26-96-41(61(90)91)29-98-109(94,95)108-66-56(57(107-67(71)92)69(11,93)58(106-66)59(70)88)105-63-44(73-36(8)77)47(82)54(40(101-63)28-97-64-51(86)48(83)45(80)39(27-75)100-64)103-62-43(72-35(7)76)46(81)53(34(6)99-62)102-65-52(87)49(84)50(85)55(104-65)60(89)74-42-37(78)20-21-38(42)79/h13,15,18,23-24,34,39-41,43-58,62-66,75,78,80-87,93H,5,12,14,16-17,19-22,25-29H2,1-4,6-11H3,(H2,70,88)(H2,71,92)(H,72,76)(H,73,77)(H,74,89)(H,90,91)(H,94,95)/b24-13+,31-18+,32-23-/t34-,39-,40-,41-,43-,44-,45-,46-,47-,48+,49+,50-,51-,52-,53-,54-,55+,56-,57-,58-,62+,63+,64-,65-,66-,69+/m1/s1 |
| SMILES | C[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)O[C@@H]2[C@H](O[C@H]([C@@H]([C@H]2O)NC(=O)C)O[C@@H]3[C@H]([C@]([C@H](O[C@@H]3OP(=O)(O)OC[C@H](C(=O)O)OC/C=C(/C)\CC/C=C/C(C)(C)CCC(=C)C/C=C(\C)/CCC=C(C)C)C(=O)N)(C)O)OC(=O)N)CO[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)NC(=O)C)O)O[C@H]5[C@@H]([C@H]([C@H]([C@H](O5)C(=O)NC6=C(CCC6=O)O)O)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Huber, G; Schacht, U; Weidenmüller, H l; Schmidt-thomé, J; Duphorn, J; Tschesche, R Meonomycin, a new antibiotic. II. Characterization and chemistry Antimicrobial Agents and Chemotherapy 1965 5 737-742. | ||
|---|---|---|---|
| DOI | 10.5281/zenodo.3541234 | PMID | 5883491 |
SYNTHESES
| CITATION 1 | Taylor JG; Li X; Oberthür M; Zhu W; Kahne DE The total synthesis of moenomycin A. Journal of the American Chemical Society 2006 128 (47) 15084-5. DOI: 10.1021/ja065907x PMID: 17117848 | ||
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