Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA016359
PROPERTIES
| NPAID | NPA016359 |
|---|---|
| CLUSTER ID | 67 |
| NODE ID | 11 |
| NAME | (+)-acetodalmanol B |
| FORMULA | C32H26O9 |
| MOLECULAR WEIGHT (Da) | 554.5510 |
| ACCURATE MASS (Da) | 554.1577 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Daldinia |
| ORIGIN SPECIES | eschscholzii |
| InChIKey | QGXAARBBGWHTQS-GIYNXVAASA-N |
| InChI | InChI=1S/C32H26O9/c1-12(10-18(37)25-15(34)6-4-7-16(25)35)22-13(2)23-30-27(32(40)24(14(3)33)31(23)39)19(38)11-21-28(30)29(22)26-17(36)8-5-9-20(26)41-21/h4-9,11-13,22,33-35,39-40H,10H2,1-3H3/t12-,13-,22-/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)[C@H](C)CC(=O)C6=C(C=CC=C6O)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 |
