Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA031582
PROPERTIES
| NPAID | NPA031582 |
|---|---|
| CLUSTER ID | 9192 |
| NODE ID | 6171 |
| NAME | Bosamycin D |
| FORMULA | C51H68N8O18 |
| MOLECULAR WEIGHT (Da) | 1081.1430 |
| ACCURATE MASS (Da) | 1080.4652 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | sp. 120454 |
| InChIKey | JYQBRRHPVQLUCY-ZJPHBKLHSA-N |
| InChI | InChI=1S/C51H68N8O18/c1-25(2)17-34(44(68)52-23-41(65)66)54-47(71)38(21-30-11-16-33(64)22-40(30)77-6)57-49(73)39(24-60)58-50(74)42(43(67)51(75)76)59-48(72)35(18-26(3)4)55-46(70)37(20-29-9-14-32(63)15-10-29)56-45(69)36(53-27(5)61)19-28-7-12-31(62)13-8-28/h7-16,22,25-26,34-39,42-43,60,62-64,67H,17-21,23-24H2,1-6H3,(H,52,68)(H,53,61)(H,54,71)(H,55,70)(H,56,69)(H,57,73)(H,58,74)(H,59,72)(H,65,66)(H,75,76)/t34-,35-,36-,37+,38+,39-,42-,43+/m0/s1 |
| SMILES | COC1=C(C[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC2=CC=C(O)C=C2)NC(=O)[C@H](CC2=CC=C(O)C=C2)NC(C)=O)[C@@H](O)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)O)C=CC(O)=C1 |
ORIGINAL ISOLATION REFERENCE
| CITATION | Xu, Zi Fei; Bo, Sheng Tao; Wang, Mei Jing; Shi, Jing; Jiao, Rui Hua; Sun, Yang; Xu, Qiang; Tan, Ren Xiang; Ge, Hui Ming Discovery and biosynthesis of bosamycins from Streptomyces sp. 120454. Chemical Science 2020 11 (34) 9237-9245. | ||
|---|---|---|---|
| DOI | 10.1039/d0sc03469j | PMID | 34094195 |
