Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA029610
PROPERTIES
| NPAID | NPA029610 |
|---|---|
| CLUSTER ID | 26 |
| NODE ID | 25 |
| NAME | Rufomycin NBZ4 |
| FORMULA | C54H78N8O8 |
| MOLECULAR WEIGHT (Da) | 967.2660 |
| ACCURATE MASS (Da) | 966.5943 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | atratus Strain MJM3502 |
| InChIKey | TXCVCQMUCABDIS-HSNUYATMSA-N |
| InChI | InChI=1S/C54H78N8O8/c1-14-16-20-40-47(64)59-43(30-37-31-62(54(10,11)15-2)44-21-18-17-19-39(37)44)53(70)61(13)46(28-34(7)8)51(68)58-42(29-36-22-24-38(63)25-23-36)48(65)55-35(9)52(69)60(12)45(27-33(5)6)50(67)57-41(26-32(3)4)49(66)56-40/h14-19,21-25,31-35,40-43,45-46,63H,2,20,26-30H2,1,3-13H3,(H,55,65)(H,56,66)(H,57,67)(H,58,68)(H,59,64)/b16-14+/t35-,40-,41-,42-,43-,45-,46-/m0/s1 |
| SMILES | C=CC(C)(C)N1C=C(C[C@@H]2NC(=O)[C@H](C/C=C/C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](C)NC(=O)[C@H](CC3=CC=C(O)C=C3)NC(=O)[C@H](CC(C)C)N(C)C2=O)C2=CC=CC=C21 |
ORIGINAL ISOLATION REFERENCE
| CITATION | Abad-Zapatero, Cele; Bisson, Jonathan; Chen, Shao-Nong; Cheng, Jinhua; Cho, Sang-Hyun; Franzblau, Scott G.; Jin, Yingyu; Klein, Larry L.; Lee, Hanki; Lee, Hyun; McAlpine, James B.; Pauli, Guido F.; Santarsiero, Bernard D.; Shetye, Gauri; Suh, Joo-Won; Wolf, Nina M.; Yu, Yang; Zhou, Bin Antimycobacterial Rufomycin Analogues from Streptomyces atratus Strain MJM3502 Journal of Natural Products 2020 83 (3) 657-667. | ||
|---|---|---|---|
| DOI | 10.1021/acs.jnatprod.9b01095 | PMID | 32031795 |
