Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA003662
PROPERTIES
NPAID | NPA003662 |
---|---|
CLUSTER ID | 207 |
NODE ID | 194 |
NAME | (+)-oxanthromicin |
FORMULA | C36H30O12 |
MOLECULAR WEIGHT (Da) | 654.6240 |
ACCURATE MASS (Da) | 654.1737 |
ORIGIN ORGANISM TYPE | Bacterium |
ORIGIN GENUS | Streptomyces |
ORIGIN SPECIES | sp. |
InChIKey | IEVJARSTOGQGJT-ZPGRZCPFSA-N |
InChI | InChI=1S/C36H30O12/c1-13-7-9-17-27(29(13)39)31(41)23-15(3)25(33(43)44)21(37)11-19(23)35(17,5)47-48-36(6)18-10-8-14(2)30(40)28(18)32(42)24-16(4)26(34(45)46)22(38)12-20(24)36/h7-12,37-40H,1-6H3,(H,43,44)(H,45,46)/t35-,36-/m0/s1 |
SMILES | CC1=C(C2=C(C=C1)[C@](C3=CC(=C(C(=C3C2=O)C)C(=O)O)O)(C)OO[C@]4(C5=C(C(=C(C=C5)C)O)C(=O)C6=C(C(=C(C=C64)O)C(=O)O)C)C)O |
ORIGINAL ISOLATION REFERENCE
CITATION | Salim, Angela A.; Xiao, Xue; Cho, Kwang-Jin; Piggott, Andrew M.; Lacey, Ernest; Hancock, John F.; Capon, Robert J. Rare Streptomyces sp. polyketides as modulators of K-Ras localisation Organic & Biomolecular Chemistry 2014 12 (27) 4872-4878. | ||
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DOI | 10.1039/c4ob00745j | PMID | 24875924 |