Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA016398
PROPERTIES
| NPAID | NPA016398 |
|---|---|
| CLUSTER ID | 603 |
| NODE ID | 536 |
| NAME | Nocathiacin I |
| FORMULA | C61H60N14O18S5 |
| MOLECULAR WEIGHT (Da) | 1437.5660 |
| ACCURATE MASS (Da) | 1436.2814 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Nocardia |
| ORIGIN SPECIES | sp. WW-12651 |
| InChIKey | FFLJEMWVYVKPDW-UMNFMQIXSA-N |
| InChI | InChI=1S/C61H60N14O18S5/c1-22(48(62)78)63-49(79)31-19-97-57(68-31)42-36(77)12-27-41(70-42)30-17-95-55(65-30)29-16-91-59(84)44-28-15-89-45(46(93-37-13-61(5,86)47(74(6)7)25(4)92-37)60(85)90-14-26-10-9-11-35(38(26)28)75(44)87)43(58-69-32(20-98-58)50(80)64-29)73-52(82)34-21-96-56(67-34)40(24(3)88-8)72-53(83)39(23(2)76)71-51(81)33-18-94-54(27)66-33/h9-12,17-21,23,25,29,37,39,43,45-47,76-77,86-87H,1,13-16H2,2-8H3,(H2,62,78)(H,63,79)(H,64,80)(H,71,81)(H,72,83)(H,73,82)/b40-24+/t23-,25+,29+,37+,39+,43+,45+,46+,47-,61+/m1/s1 |
| SMILES | C[C@H]1[C@H]([C@@](C[C@@H](O1)O[C@H]2[C@@H]3[C@H]4C5=NC(=CS5)C(=O)N[C@@H](COC(=O)C6=C(CO3)C7=C(COC2=O)C=CC=C7N6O)C8=NC(=CS8)C9=NC(=C(C=C9C1=NC(=CS1)C(=O)N[C@H](C(=O)N/C(=C(\C)/OC)/C1=NC(=CS1)C(=O)N4)[C@@H](C)O)O)C1=NC(=CS1)C(=O)NC(=C)C(=O)N)(C)O)N(C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Li, Wenying; Leet, John E.; Ax, Helen A.; Gustavson, Donald R.; Brown, Daniel M.; Turner, Laura; Brown, Kimberly; Clark, Junius; Yang, Hyekyung; Fung-Tomc, Joan; Lam, Kin S. Nocathiacins, new thiazolyl peptide antibiotics from Nocardia sp. I. Taxonomy, fermentation and biological activities Journal of Antibiotics 2003 56 (3) 226-231. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.56.226 | PMID | 12760678 |
