Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA029609
PROPERTIES
| NPAID | NPA029609 |
|---|---|
| CLUSTER ID | 26 |
| NODE ID | 25 |
| NAME | Rufomycin NBZ2 |
| FORMULA | C54H77N9O12 |
| MOLECULAR WEIGHT (Da) | 1044.2610 |
| ACCURATE MASS (Da) | 1043.5692 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | atratus Strain MJM3502 |
| InChIKey | DGKNQNVQRNNGQR-PCLHXPAESA-N |
| InChI | InChI=1S/C54H77N9O12/c1-12-13-17-37-47(66)59-40(26-35-27-62(54(8,9)46-29-75-46)41-18-15-14-16-36(35)41)53(72)61(11)43(22-31(4)5)50(69)58-39(24-34-19-20-45(65)42(25-34)63(73)74)48(67)55-33(7)52(71)60(10)44(23-32(6)28-64)51(70)57-38(21-30(2)3)49(68)56-37/h12-16,18-20,25,27,30-33,37-40,43-44,46,64-65H,17,21-24,26,28-29H2,1-11H3,(H,55,67)(H,56,68)(H,57,70)(H,58,69)(H,59,66)/b13-12+/t32-,33+,37+,38+,39+,40+,43+,44+,46-/m1/s1 |
| SMILES | C/C=C/C[C@@H]1NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C[C@@H](C)CO)N(C)C(=O)[C@H](C)NC(=O)[C@H](CC2=CC([N+](=O)[O-])=C(O)C=C2)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC2=CN(C(C)(C)[C@H]3CO3)C3=CC=CC=C23)NC1=O |
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 |
