Compounds
ID | Spectrum Quality | Annotated Name |
---|---|---|
CCMSLIB00000852525 | Gold | 1!CCMSLIB00000852527 |
COMPOUND NPA005953
PROPERTIES
NPAID | NPA005953 |
---|---|
CLUSTER ID | 106 |
NODE ID | 101 |
NAME | Isochromophilone VIII |
FORMULA | C21H27ClO5 |
MOLECULAR WEIGHT (Da) | 394.8950 |
ACCURATE MASS (Da) | 394.1547 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Penicillium |
ORIGIN SPECIES | sp. FO-4164 |
InChIKey | MMOJJYPBNVVCGY-LYLCUPBQSA-N |
InChI | InChI=1S/C21H27ClO5/c1-6-12(2)9-13(3)7-8-15-10-16-17(11-26-15)20(27-14(4)23)21(5,25)19(24)18(16)22/h7-10,12,17,20,25H,6,11H2,1-5H3/b8-7+,13-9+/t12?,17-,20-,21+/m1/s1 |
SMILES | CCC(C)/C=C(\C)/C=C/C1=CC2=C(C(=O)[C@]([C@@H]([C@@H]2CO1)OC(=O)C)(C)O)Cl |
ORIGINAL ISOLATION REFERENCE
CITATION | Yang, Da-Jun; Tomoda, Hiroshi; Tabata, Noriko; Masuma, Rokuro; Omura, Satoshi New isochromophilones VII and VIII produced by Penicillium sp. FO-4164 Journal of Antibiotics 1996 49 (3) 223-229. | ||
---|---|---|---|
DOI | 10.7164/antibiotics.49.223 | PMID | 8626234 |