Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA026730
PROPERTIES
| NPAID | NPA026730 |
|---|---|
| CLUSTER ID | 8076 |
| NODE ID | 5480 |
| NAME | Rifamycinoside B |
| FORMULA | C40H53NO15 |
| MOLECULAR WEIGHT (Da) | 787.8560 |
| ACCURATE MASS (Da) | 787.3415 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Amycolatopsis |
| ORIGIN SPECIES | mediterranei S699 |
| InChIKey | WELZFORFRLYQLJ-YYNBBNTOSA-N |
| InChI | InChI=1S/C40H53NO15/c1-15-10-9-11-16(2)37(51)41-22-14-23(42)25-26(33(22)48)31(46)20(6)36(54-39-35(50)34(49)32(47)21(7)53-39)27(25)38(52)56-40(8)13-12-24(55-40)17(3)29(44)19(5)30(45)18(4)28(15)43/h9-11,14-15,17-19,21,24,28-30,32,34-35,39,43-47,49-50H,12-13H2,1-8H3,(H,41,51)/b10-9+,16-11+/t15-,17+,18+,19-,21-,24-,28-,29+,30+,32-,34+,35+,39-,40-/m0/s1 |
| SMILES | C/C1=C\C=C\[C@H](C)[C@H](O)[C@@H](C)[C@@H](O)[C@@H](C)[C@H](O)[C@H](C)[C@@H]2CC[C@](C)(OC(=O)C3=C(O[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)C(C)=C(O)C4=C3C(=O)C=C(NC1=O)C4=O)O2 |
ORIGINAL ISOLATION REFERENCE
| CITATION | Shi, Yanrong; Zhang, Juanli; Tian, Xiuyu; Wu, Xingkang; Li, Tianhong; Lu, Chunhua; Shen, Yuemao Isolation of 11,12-seco-Rifamycin W Derivatives Reveals a Cleavage Pattern of the Rifamycin Ansa Chain Organic Letters 2019 21 (4) 900-903. | ||
|---|---|---|---|
| DOI | 10.1021/acs.orglett.8b03792 | PMID | 30714736 |
