Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA017125
PROPERTIES
| NPAID | NPA017125 |
|---|---|
| CLUSTER ID | 3809 |
| NODE ID | 2855 |
| NAME | Spectomycin B1 |
| FORMULA | C38H34O14 |
| MOLECULAR WEIGHT (Da) | 714.6760 |
| ACCURATE MASS (Da) | 714.1949 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | spectabilis |
| InChIKey | ORXVKHNPIHZPEJ-UHFFFAOYSA-N |
| InChI | InChI=1S/C38H34O14/c1-37(49)13-21(39)29-19(31(37)23(51-3)11-25(41)42)9-15-5-7-17(33(45)27(15)35(29)47)18-8-6-16-10-20-30(36(48)28(16)34(18)46)22(40)14-38(2,50)32(20)24(52-4)12-26(43)44/h5-12,31-32,45-50H,13-14H2,1-4H3,(H,41,42)(H,43,44) |
| SMILES | CC1(CC(=O)C2=C(C1C(=CC(=O)O)OC)C=C3C=CC(=C(C3=C2O)O)C4=C(C5=C(C6=C(C=C5C=C4)C(C(CC6=O)(C)O)C(=CC(=O)O)OC)O)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Staley; Rinehart Spectromycins, new antibacterial compounds produced by Streptomyces spectabilis: Isolation, structures, and biosynthesis Journal of Antibiotics 1994 47 (12) 1425-1433. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.47.1425 | PMID | 7844036 |
