Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00000478096 | Silver | Benzomalvin&A_120259 |
| CCMSLIB00005435768 | Bronze | Benzomalvin&A/D&putative |
COMPOUND NPA003753
PROPERTIES
| NPAID | NPA003753 |
|---|---|
| CLUSTER ID | 2039 |
| NODE ID | 11 |
| NAME | Benzomalvin A |
| FORMULA | C24H19N3O2 |
| MOLECULAR WEIGHT (Da) | 381.4350 |
| ACCURATE MASS (Da) | 381.1477 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Penicillium |
| ORIGIN SPECIES | sp. |
| InChIKey | YYWUABJYAOCACI-NRFANRHFSA-N |
| InChI | InChI=1S/C24H19N3O2/c1-26-21(15-16-9-3-2-4-10-16)22-25-19-13-7-5-11-17(19)24(29)27(22)20-14-8-6-12-18(20)23(26)28/h2-14,21H,15H2,1H3/t21-/m0/s1 |
| SMILES | CN1[C@H](C2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4C1=O)CC5=CC=CC=C5 |
ORIGINAL ISOLATION REFERENCE
| CITATION | Sun; Barrow; Sedlock; Gillum; Cooper Benzomalvins, new substance P inhibitors from a Penicillium sp Journal of Antibiotics 1994 47 (5) 515-522. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.47.515 | PMID | 7518818 |
