Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA017167
PROPERTIES
| NPAID | NPA017167 |
|---|---|
| CLUSTER ID | 414 |
| NODE ID | 373 |
| NAME | 9-hydroxyfumitremorgin C |
| FORMULA | C22H25N3O4 |
| MOLECULAR WEIGHT (Da) | 395.4590 |
| ACCURATE MASS (Da) | 395.1845 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Aspergillus |
| ORIGIN SPECIES | fumigatus YK-7 |
| InChIKey | GAQLGONAVPUXSP-NPPFBWRTSA-N |
| InChI | InChI=1S/C22H25N3O4/c1-12(2)9-18-19-15(14-7-6-13(29-3)10-16(14)23-19)11-22(28)21(27)24-8-4-5-17(24)20(26)25(18)22/h6-7,9-10,17-18,23,28H,4-5,8,11H2,1-3H3/t17-,18-,22+/m0/s1 |
| SMILES | CC(=C[C@H]1C2=C(C[C@@]3(N1C(=O)[C@@H]4CCCN4C3=O)O)C5=C(N2)C=C(C=C5)OC)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Wang, Yu; Li, Zhan-Lin; Bai, Jiao; Zhang, Li-Min; Wu, Xin; Zhang, Lin; Pei, Yue-Hu; Jing, Yong-Kui; Hua, Hui-Ming 2,5-Diketopiperazines from the Marine-Derived Fungus Aspergillus fumigatus YK-7 Chemistry and Biodiversity 2012 9 (2) 385-393. | ||
|---|---|---|---|
| DOI | 10.1002/cbdv.201100061 | PMID | 22344914 |
