Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA016748
PROPERTIES
NPAID | NPA016748 |
---|---|
CLUSTER ID | 785 |
NODE ID | 681 |
NAME | CJ-15,183 |
FORMULA | C28H38O13 |
MOLECULAR WEIGHT (Da) | 582.5990 |
ACCURATE MASS (Da) | 582.2312 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Aspergillus |
ORIGIN SPECIES | aculeatus |
InChIKey | SCNKZRBYVALSHS-OXXZWVFOSA-N |
InChI | InChI=1S/C28H38O13/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-15-20(26(37)40-18)28(39,17-22(31)32)27(38)41-23(25(35)36)19(24(33)34)16-21(29)30/h6-7,9-10,13-14,18-20,23,39H,2-5,8,11-12,15-17H2,1H3,(H,29,30)(H,31,32)(H,33,34)(H,35,36)/b7-6-,10-9-,14-13+ |
SMILES | CCCCC/C=C\C/C=C\CC/C=C/C1CC(C(=O)O1)C(CC(=O)O)(C(=O)OC(C(CC(=O)O)C(=O)O)C(=O)O)O |
ORIGINAL ISOLATION REFERENCE
CITATION | Watanabe; Hirai; Ishiguro; Kambara; Kojima; Matsunaga; Nishida; Suzuki; Sugiura; Harwood H.J.; Huang CJ-15,183, a new inhibitor of squalene synthase produced by a fungus, Aspergillus aculeatus Journal of Antibiotics 2001 54 (11) 904-910. | ||
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DOI | 10.7164/antibiotics.54.904 | PMID | 11827032 |