Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA019792
PROPERTIES
| NPAID | NPA019792 |
|---|---|
| CLUSTER ID | 382 |
| NODE ID | 344 |
| NAME | Microsphaerone A |
| FORMULA | C22H27NO8 |
| MOLECULAR WEIGHT (Da) | 433.4570 |
| ACCURATE MASS (Da) | 433.1737 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Unknown-fungus |
| ORIGIN SPECIES | sp. |
| InChIKey | VXFQAPGOPXEMPB-ZDHJVBDKSA-N |
| InChI | InChI=1S/C22H27NO8/c1-15(22(29)30)12-19(25)23-21(28)17-14-31-16(13-18(17)24)10-8-6-4-2-3-5-7-9-11-20(26)27/h4,6,8,10,13-15H,2-3,5,7,9,11-12H2,1H3,(H,26,27)(H,29,30)(H,23,25,28)/b6-4+,10-8+/t15-/m0/s1 |
| SMILES | C[C@@H](CC(=O)NC(=O)C1=COC(=CC1=O)/C=C/C=C/CCCCCCC(=O)O)C(=O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Wang, Chang-yun; Wang, Bin-gui; Brauers, Gernot; Guan, Hua-shi; Proksch, Peter; Ebel, Rainer Microsphaerones A and B, two novel γ-pyrone derivatives from the sponge-derived fungus Microsphaeropsis sp Journal of Natural Products 2002 65 (5) 772-775. | ||
|---|---|---|---|
| DOI | 10.1021/np0104828 | PMID | 12027766 |
