Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA018056
PROPERTIES
| NPAID | NPA018056 |
|---|---|
| CLUSTER ID | 186 |
| NODE ID | 174 |
| NAME | Herbarin A |
| FORMULA | C12H12O5 |
| MOLECULAR WEIGHT (Da) | 236.2230 |
| ACCURATE MASS (Da) | 236.0685 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Cladosporium |
| ORIGIN SPECIES | herbarum |
| InChIKey | ISQQPILYSRJHBC-GGWOSOGESA-N |
| InChI | InChI=1S/C12H12O5/c1-8-9(5-3-4-6-11(13)14)17-12(15)7-10(8)16-2/h3-7H,1-2H3,(H,13,14)/b5-3+,6-4+ |
| SMILES | CC1=C(OC(=O)C=C1OC)/C=C/C=C/C(=O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Jadulco, Raquel; Brauers, Gernot; Edrada, Ru Angelie; Ebel, Rainer; Wray, Victor; Sudarsono, ; Proksch, Peter New Metabolites from Sponge-Derived Fungi Curvularia lunata and Cladosporium herbarum Journal of Natural Products 2002 65 (5) 730-733. | ||
|---|---|---|---|
| DOI | 10.1021/np010390i | PMID | - |
SYNTHESES
| CITATION 1 | Heimberger J; Cade HC; Padgett J; Sittaramane V; Shaikh A Total synthesis of Herbarin A and B, determination of their antioxidant properties and toxicity in zebrafish embryo model. Bioorganic and Medicinal Chemistry Letters 2015 25 (6) 1192-5. DOI: 10.1016/j.bmcl.2015.01.065 PMID: 25690788 | ||
|---|---|---|---|
