Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA023106
PROPERTIES
| NPAID | NPA023106 |
|---|---|
| CLUSTER ID | 22 |
| NODE ID | 21 |
| NAME | Penicimarin I |
| FORMULA | C13H14O5 |
| MOLECULAR WEIGHT (Da) | 250.2500 |
| ACCURATE MASS (Da) | 250.0841 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Penicillium |
| ORIGIN SPECIES | citrinum |
| InChIKey | DOFCTMZPVWXBQU-SECBINFHSA-N |
| InChI | InChI=1S/C13H14O5/c1-17-11(15)6-5-9-7-8-3-2-4-10(14)12(8)13(16)18-9/h2-4,9,14H,5-7H2,1H3/t9-/m1/s1 |
| SMILES | COC(=O)CC[C@@H]1CC2=C(C(=CC=C2)O)C(=O)O1 |
ORIGINAL ISOLATION REFERENCE
| CITATION | Huang, Guo-Lei; Zhou, Xue-Ming; Bai, Meng; Liu, Yu-Xin; Zhao, Yan-Lei; Luo, You-Ping; Niu, Yan-Yan; Zheng, Cai-Juan; Chen, Guang-Ying Dihydroisocoumarins from the mangrove-derived fungus Penicillium citrinum Marine Drugs 2016 14 (10) None. | ||
|---|---|---|---|
| DOI | 10.3390/md14100177 | PMID | 27735855 |
