Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA018206
PROPERTIES
NPAID | NPA018206 |
---|---|
CLUSTER ID | 436 |
NODE ID | 394 |
NAME | Emeremophiline |
FORMULA | C27H36O6 |
MOLECULAR WEIGHT (Da) | 456.5790 |
ACCURATE MASS (Da) | 456.2512 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Emericella |
ORIGIN SPECIES | aurantiobrunnea |
InChIKey | DNSSJKQHFCIVIW-HEMGCLFMSA-N |
InChI | InChI=1S/C27H36O6/c1-8-17(2)13-18(3)9-12-25(30)33-23-11-10-22-14-24(29)27(31,16-26(22,7)20(23)5)19(4)15-32-21(6)28/h9-14,17,20,23,31H,4,8,15-16H2,1-3,5-7H3/b12-9+,18-13+ |
SMILES | CCC(C)/C=C(\C)/C=C/C(=O)OC1C=CC2=CC(=O)C(CC2(C1C)C)(C(=C)COC(=O)C)O |
ORIGINAL ISOLATION REFERENCE
CITATION | Fujimoto, H; Nakamura, E; Okuyama, E; Ishibashi, M Immunomodulatory constituents from an ascomycete, Emericella aurantio-brunnea Chemical and Pharmaceutical Bulletin 2000 48 (10) 1436-1441. | ||
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DOI | 10.1248/cpb.48.1436 | PMID | 11045446 |