Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA001964
PROPERTIES
| NPAID | NPA001964 |
|---|---|
| CLUSTER ID | 11 |
| NODE ID | 11 |
| NAME | Citreoisocoumarin |
| FORMULA | C14H14O6 |
| MOLECULAR WEIGHT (Da) | 278.2600 |
| ACCURATE MASS (Da) | 278.0790 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Penicillium |
| ORIGIN SPECIES | sp. |
| InChIKey | OSPHTXUUCFLMQA-SECBINFHSA-N |
| InChI | InChI=1S/C14H14O6/c1-7(15)2-9(16)5-11-4-8-3-10(17)6-12(18)13(8)14(19)20-11/h3-4,6,9,16-18H,2,5H2,1H3/t9-/m1/s1 |
| SMILES | CC(=O)C[C@H](CC1=CC2=CC(=CC(=C2C(=O)O1)O)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Watanabe, Akira; Ono, Yuya; Fujii, Isao; Sankawa, Ushio; Mayorga, María E; Timberlake, William E; Ebizuka, Yutaka Product identification of polyketide synthase coded by Aspergillus nidulans wA gene Tetrahedron Letters 1998 39 (42) 7733-7736. | ||
|---|---|---|---|
| DOI | 10.1016/s0040-4039(98)01685-2 | PMID | - |
