Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA004896
PROPERTIES
| NPAID | NPA004896 |
|---|---|
| CLUSTER ID | 2472 |
| NODE ID | 1940 |
| NAME | Fumitremorgin D |
| FORMULA | C40H41N3O11 |
| MOLECULAR WEIGHT (Da) | 739.7780 |
| ACCURATE MASS (Da) | 739.2741 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Aspergillus |
| ORIGIN SPECIES | fumigatus |
| InChIKey | JFCHGIIEFAWEJI-BKUUUEHISA-N |
| InChI | InChI=1S/C40H41N3O11/c1-19(2)13-27-34-32(23-11-10-22(50-4)18-25(23)41-34)36(40(53-7)39(49)42-12-8-9-26(42)37(47)43(27)40)54-38(48)24-16-21(44)17-30(52-6)31(24)35(46)33-28(45)14-20(3)15-29(33)51-5/h10-11,13-18,26-27,36,41,44-45H,8-9,12H2,1-7H3/t26-,27-,36-,40?/m0/s1 |
| SMILES | CC1=CC(=C(C(=C1)OC)C(=O)C2=C(C=C(C=C2C(=O)O[C@H]3C4=C([C@@H](N5C3(C(=O)N6CCC[C@H]6C5=O)OC)C=C(C)C)NC7=C4C=CC(=C7)OC)O)OC)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Liang, Zizhen; Zhang, Tiantian; Zhang, Xiaoqian; Zhang, Jia; Zhao, Changqi An alkaloid and a steroid from the endophytic fungus Aspergillus fumigatus Molecules 2015 20 (1) 1424-1433. | ||
|---|---|---|---|
| DOI | 10.3390/molecules20011424 | PMID | 25594349 |
