Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA026732
PROPERTIES
| NPAID | NPA026732 |
|---|---|
| CLUSTER ID | 216 |
| NODE ID | 203 |
| NAME | 27,28-epoxy-28-desmethylrifamycin W |
| FORMULA | C34H41NO10 |
| MOLECULAR WEIGHT (Da) | 623.6990 |
| ACCURATE MASS (Da) | 623.2730 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Amycolatopsis |
| ORIGIN SPECIES | mediterranei S699 |
| InChIKey | MTXOORLVWYTJID-VIDMMWRBSA-N |
| InChI | InChI=1S/C34H41NO10/c1-13-9-8-10-14(2)34(44)35-20-12-21(36)23-24(30(41)18(6)31(42)25(23)32(20)43)27(38)15(3)11-22-33(45-22)19(7)29(40)17(5)28(39)16(4)26(13)37/h8-13,16-17,19,22,26,28-29,33,37,39-42H,1-7H3,(H,35,44)/b9-8+,14-10-,15-11+/t13-,16+,17+,19-,22?,26-,28+,29-,33?/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)C2OC2/C=C(\C)C(=O)C2=C3C(=O)C=C(NC1=O)C(=O)C3=C(O)C(C)=C2O |
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 |
