Compounds
ID | Spectrum Quality | Annotated Name |
---|---|---|
CCMSLIB00005727898 | Gold | 3 |
CCMSLIB00005727376 | Gold | 3 |
CCMSLIB00005727291 | Gold | 3 |
CCMSLIB00005727191 | Gold | 3 |
CCMSLIB00005727872 | Gold | 3 |
CCMSLIB00006675752 | Gold | 3 |
COMPOUND NPA005768
PROPERTIES
NPAID | NPA005768 |
---|---|
CLUSTER ID | 2797 |
NODE ID | 2164 |
NAME | Penicillic acid |
FORMULA | C8H10O4 |
MOLECULAR WEIGHT (Da) | 170.1640 |
ACCURATE MASS (Da) | 170.0579 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Penicillium |
ORIGIN SPECIES | puberulum |
InChIKey | VOUGEZYPVGAPBB-XQRVVYSFSA-N |
InChI | InChI=1S/C8H10O4/c1-5(2)8(11)6(12-3)4-7(9)10/h4H,1H2,2-3H3,(H,9,10)/b6-4- |
SMILES | CC(=C)C(=O)/C(=C/C(=O)O)/OC |
ORIGINAL ISOLATION REFERENCE
CITATION | Birkinshaw, J H; Oxford, A E; Raistrick, H Studies in the biochemistry of micro-organisms: Penicillic acid, a metabolic product of Penicillium puberulum Bainier and P. cylopium Westling Biochemical Journal 1936 30 (3) 394. | ||
---|---|---|---|
DOI | 10.1042/bj0300394 | PMID | 16746037 |