Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA014350
PROPERTIES
| NPAID | NPA014350 |
|---|---|
| CLUSTER ID | 84 |
| NODE ID | 79 |
| NAME | Isovanillobiocin |
| FORMULA | C31H31ClN2O12 |
| MOLECULAR WEIGHT (Da) | 659.0440 |
| ACCURATE MASS (Da) | 658.1566 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | roseochromogenes DS12.976 |
| InChIKey | AKYRQFMQZJFLAE-UHFFFAOYSA-N |
| InChI | InChI=1S/C31H31ClN2O12/c1-13-6-9-16(33-13)28(39)45-25-23(37)26(42-5)31(2,3)46-30(25)43-18-11-8-15-22(36)21(29(40)44-24(15)20(18)32)34-27(38)14-7-10-17(35)19(12-14)41-4/h6-12,23,25-26,30,33,35-37H,1-5H3,(H,34,38) |
| SMILES | CC1=CC=C(N1)C(=O)OC2C(C(C(OC2OC3=C(C4=C(C=C3)C(=C(C(=O)O4)NC(=O)C5=CC(=C(C=C5)O)OC)O)Cl)(C)C)OC)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Freitag, Anja; Galm, Ute; Li, Shu-Ming; Heide, Lutz New aminocoumarin antibiotics from a cloQ-defective mutant of the clorobiocin. Producer Streptomyces roseochromogenes DS12.976 Journal of Antibiotics 2004 57 (3) 205-209. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.57.205 | PMID | 15152806 |
