Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA024757
PROPERTIES
NPAID | NPA024757 |
---|---|
CLUSTER ID | 7577 |
NODE ID | 5187 |
NAME | JBIR-73 |
FORMULA | C28H41N4O5S+ |
MOLECULAR WEIGHT (Da) | 545.7260 |
ACCURATE MASS (Da) | 545.2792 |
ORIGIN ORGANISM TYPE | Bacterium |
ORIGIN GENUS | Streptomyces |
ORIGIN SPECIES | sp. RI18 |
InChIKey | YOBJSABMZUGORZ-IGSWUVHTSA-O |
InChI | InChI=1S/C28H40N4O5S/c1-17(2)18(3)10-11-28(16-37-7)24(13-20-12-19(25(33)34)8-9-22(20)31-28)38-27-29-15-21(30-27)14-23(26(35)36)32(4,5)6/h8-9,12,15,23-24,31H,10-11,13-14,16H2,1-7H3,(H2-,29,30,33,34,35,36)/p+1/t23?,24?,28-/m1/s1 |
SMILES | CC(=C(C)CC[C@]1(C(CC2=C(N1)C=CC(=C2)C(=O)O)SC3=NC=C(N3)CC(C(=O)O)[N+](C)(C)C)COC)C |
ORIGINAL ISOLATION REFERENCE
CITATION | Motohashi K; Nagai A; Takagi M; Shin-ya K Two novel benzastatin derivatives, JBIR-67 and JBIR-73, isolated from Streptomyces sp. RI18. Journal of Antibiotics 2011 64 (3) 281-283. | ||
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DOI | 10.1038/ja.2010.169 | PMID | 21224859 |