Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA022829
PROPERTIES
| NPAID | NPA022829 |
|---|---|
| CLUSTER ID | 26 |
| NODE ID | 25 |
| NAME | Albucyclone B |
| FORMULA | C58H85N11O11 |
| MOLECULAR WEIGHT (Da) | 1112.3840 |
| ACCURATE MASS (Da) | 1111.6430 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | sp. JAMM992 |
| InChIKey | NQOBVPUFNGRKAP-ZCXMVGRJSA-N |
| InChI | InChI=1S/C58H85N11O11/c1-13-32(8)46-56(78)62-35(11)50(72)66-45(31(6)7)55(77)69-48(34(10)15-3)57(79)63-39(23-19-20-24-61-51(73)38-29-60-28-37-44(38)43(70)27-40(59-12)49(37)71)52(74)67-47(33(9)14-2)58(80)65-42(26-36-21-17-16-18-22-36)53(75)64-41(25-30(4)5)54(76)68-46/h16-18,21-22,27-35,39,41-42,45-48,59H,13-15,19-20,23-26H2,1-12H3,(H,61,73)(H,62,78)(H,63,79)(H,64,75)(H,65,80)(H,66,72)(H,67,74)(H,68,76)(H,69,77)/t32-,33-,34+,35+,39-,41+,42+,45-,46-,47-,48+/m0/s1 |
| SMILES | CC[C@H](C)[C@H]1C(=O)N[C@@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N1)CCCCNC(=O)C2=C3C(=O)C=C(C(=O)C3=CN=C2)NC)[C@H](C)CC)C(C)C)C)[C@@H](C)CC)CC(C)C)CC4=CC=CC=C4 |
ORIGINAL ISOLATION REFERENCE
| CITATION | Xu, Fei; Nazari, Behnam; Moon, Kyuho; Bushin, Leah B.; Seyedsayamdost, Mohammad R. Discovery of a Cryptic Antifungal Compound from Streptomyces albus J1074 Using High-Throughput Elicitor Screens Journal of the American Chemical Society 2017 139 (27) 9203-9212. | ||
|---|---|---|---|
| DOI | 10.1021/jacs.7b02716 | PMID | 28590725 |
