Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA021293
PROPERTIES
| NPAID | NPA021293 |
|---|---|
| CLUSTER ID | 46 |
| NODE ID | 11 |
| NAME | Epelmycin B |
| FORMULA | C42H51NO16 |
| MOLECULAR WEIGHT (Da) | 825.8610 |
| ACCURATE MASS (Da) | 825.3208 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | violaceus |
| InChIKey | DKXGZTHFCJJLIP-PGFBMTGHSA-N |
| InChI | InChI=1S/C42H51NO16/c1-8-42(51)15-25(29-30(33(42)40(50)52-7)37(49)31-32(36(29)48)35(47)28-19(34(31)46)10-9-11-21(28)44)57-26-12-20(43(5)6)38(17(3)53-26)58-27-14-23-39(18(4)54-27)59-41-24(56-23)13-22(45)16(2)55-41/h9-11,16-18,20,23-27,33,38-39,41,44,48-49,51H,8,12-15H2,1-7H3/t16-,17-,18-,20+,23-,24-,25+,26-,27+,33-,38-,39+,41+,42+/m0/s1 |
| SMILES | CC[C@]1(C[C@H](C2=C(C3=C(C(=C2[C@H]1C(=O)OC)O)C(=O)C4=C(C3=O)C(=CC=C4)O)O)O[C@H]5C[C@H]([C@H]([C@@H](O5)C)O[C@@H]6C[C@H]7[C@@H]([C@@H](O6)C)O[C@@H]8[C@@H](O7)CC(=O)[C@@H](O8)C)N(C)C)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Johdo O; Ishikura T; Yoshimoto A; Takeuchi T Anthracycline metabolites from Streptomyces violaceus A262. I. Isolation of antibiotic-blocked mutants from Streptomyces violaceus A262. Journal of Antibiotics 1991 44 (10) 1110-1120. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.44.1110 | PMID | 1955394 |
