Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA021579
PROPERTIES
| NPAID | NPA021579 |
|---|---|
| CLUSTER ID | 58 |
| NODE ID | 54 |
| NAME | 7-O-descarbamoyl-17-O-demethylreblastatin |
| FORMULA | C27H41NO7 |
| MOLECULAR WEIGHT (Da) | 491.6250 |
| ACCURATE MASS (Da) | 491.2883 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | sp. W1348 |
| InChIKey | HRHLYMXYSLWYLD-ZEEJYANVSA-N |
| InChI | InChI=1S/C27H41NO7/c1-15-10-19-13-20(14-21(29)26(19)32)28-27(33)16(2)8-7-9-22(34-5)24(30)17(3)12-18(4)25(31)23(11-15)35-6/h8,12-15,18,22-25,29-32H,7,9-11H2,1-6H3,(H,28,33)/b16-8+,17-12+ |
| SMILES | CC1CC(C(C(/C=C(/C(C(CC/C=C(/C(=O)NC2=CC(=C(C(=C2)C1)O)O)\C)OC)O)\C)C)O)OC |
ORIGINAL ISOLATION REFERENCE
| CITATION | Lee, Jae Kyoung; Jang, Jae-Hyuk; Park, Dong-Jin; Kim, Chang-Jin; Ahn, Jong Seog; Hwang, Bang Yeon; Hong, Young-Soo Identification of new geldanamycin derivatives from unexplored microbial culture extracts using a MS/MS library Journal of Antibiotics 2017 70 (3) 323-327. | ||
|---|---|---|---|
| DOI | 10.1038/ja.2016.143 | PMID | 27999445 |
