Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA013233
PROPERTIES
| NPAID | NPA013233 |
|---|---|
| CLUSTER ID | 67 |
| NODE ID | 11 |
| NAME | (-)-acetodalmanol A |
| FORMULA | C22H16O7 |
| MOLECULAR WEIGHT (Da) | 392.3630 |
| ACCURATE MASS (Da) | 392.0896 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Daldinia |
| ORIGIN SPECIES | eschscholzii |
| InChIKey | CPCSDKBGBORODJ-GLEHDBDLSA-N |
| InChI | InChI=1S/C22H16O7/c1-7-13-18-16(22(28)14(8(2)23)21(13)27)10(25)6-12-17(18)19(20(7)26)15-9(24)4-3-5-11(15)29-12/h3-7,20,23,26-28H,1-2H3/t7-,20+/m1/s1 |
| SMILES | C[C@H]1[C@@H](C2=C3C(=O)C=CC=C3OC4=CC(=O)C5=C(C(=C(C)O)C(=C1C5=C42)O)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Zhang, Ying L.; Zhang, Jie; Jiang, Nan; Lu, Yan H.; Wang, Lu; Xu, Su H.; Wang, Wei; Zhang, Gao F.; Xu, Qiang; Ge, Hui M.; Ma, Jing; Song, Yong C.; Tan, Ren X. Immunosuppressive polyketides from mantis-associated Daldinia eschscholzii Journal of the American Chemical Society 2011 133 (15) 5931-5940. | ||
|---|---|---|---|
| DOI | 10.1021/ja110932p | PMID | 21434637 |
