Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA005310
PROPERTIES
NPAID | NPA005310 |
---|---|
CLUSTER ID | 2116 |
NODE ID | 1690 |
NAME | Agrocybolactone |
FORMULA | C15H20O4 |
MOLECULAR WEIGHT (Da) | 264.3210 |
ACCURATE MASS (Da) | 264.1362 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Agrocybe |
ORIGIN SPECIES | sp. HKI 0259 |
InChIKey | FUNRAISQDFOMFQ-RSPOJEKHSA-N |
InChI | InChI=1S/C15H20O4/c1-14(2)6-5-10(16)15-9(14)4-3-8-7-18-12(11(8)15)19-13(15)17/h3,9-12,16H,4-7H2,1-2H3/t9-,10-,11+,12+,15-/m0/s1 |
SMILES | CC1(CC[C@@H]([C@@]23[C@H]1CC=C4[C@@H]2[C@H](OC4)OC3=O)O)C |
ORIGINAL ISOLATION REFERENCE
CITATION | Berg, Albrecht; Dörfelt, Heinrich; Kiet, Trinh T; Schlegel, Brigitte; Gräfe, Udo Agrocybolacton, a new bioactive metabolite from Agrocybe sp. HKI 0259 Journal of Antibiotics 2002 55 (9) 818-820. | ||
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DOI | 10.7164/antibiotics.55.818 | PMID | 12458772 |