Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA010180
PROPERTIES
| NPAID | NPA010180 |
|---|---|
| CLUSTER ID | 603 |
| NODE ID | 536 |
| NAME | Nocathiacin II |
| FORMULA | C58H54N14O18S5 |
| MOLECULAR WEIGHT (Da) | 1395.4850 |
| ACCURATE MASS (Da) | 1394.2344 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Nocardia |
| ORIGIN SPECIES | sp. WW-12651 |
| InChIKey | JLVQHFRHPZEAPL-HVLKWGBISA-N |
| InChI | InChI=1S/C58H54N14O18S5/c1-19(73)35-49(80)70-36(20(2)85-5)53-65-30(17-93-53)47(78)71-40-41-42(90-33-10-58(4,84)43(59)21(3)89-33)57(83)87-11-22-7-6-8-25-34(22)24(12-86-41)38(61-25)56(82)88-13-26(62-45(76)28-16-95-55(40)67-28)52-63-27(14-92-52)37-23(51-64-29(15-91-51)46(77)69-35)9-32(74)39(68-37)54-66-31(18-94-54)48(79)72-50(81)44(60)75/h6-9,14-19,21,26,33,35,40-43,61,73-74,84H,10-13,59H2,1-5H3,(H2,60,75)(H,62,76)(H,69,77)(H,70,80)(H,71,78)(H,72,79,81)/b36-20+/t19-,21+,26+,33+,35+,40+,41+,42+,43-,58+/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=C7N6)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(=O)C(=O)N)(C)O)N |
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 |
