Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA029614
PROPERTIES
| NPAID | NPA029614 |
|---|---|
| CLUSTER ID | 26 |
| NODE ID | 25 |
| NAME | Rufomycin NBZ8 |
| FORMULA | C54H75N9O13 |
| MOLECULAR WEIGHT (Da) | 1058.2440 |
| ACCURATE MASS (Da) | 1057.5484 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | atratus Strain MJM3502 |
| InChIKey | LQUGKKZRMQHZBT-QSUUQULHSA-N |
| InChI | InChI=1S/C54H75N9O13/c1-12-13-17-35-45(65)58-37(25-33-27-61(53(7,8)44-28-76-44)38-18-15-14-16-34(33)38)50(70)59(10)40(21-29(2)3)47(67)57-36(23-32-19-20-43(64)39(24-32)63(74)75)46(66)55-31(6)49(69)60(11)42-26-54(9,73)52(72)62(51(42)71)41(22-30(4)5)48(68)56-35/h12-16,18-20,24,27,29-31,35-37,40-42,44,52,64,72-73H,17,21-23,25-26,28H2,1-11H3,(H,55,66)(H,56,68)(H,57,67)(H,58,65)/b13-12+/t31-,35-,36-,37-,40-,41-,42-,44+,52+,54-/m0/s1 |
| SMILES | C/C=C/C[C@@H]1NC(=O)[C@H](CC(C)C)N2C(=O)[C@H](C[C@](C)(O)[C@H]2O)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 |
