Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA022767
PROPERTIES
| NPAID | NPA022767 |
|---|---|
| CLUSTER ID | 2300 |
| NODE ID | 1819 |
| NAME | 24-epi-6β,16β-diacetoxy-25-hydroxy-3,7-dioxo-29-nordammara-1,17(20)-diene-21,24-lactone |
| FORMULA | C33H44O9 |
| MOLECULAR WEIGHT (Da) | 584.7060 |
| ACCURATE MASS (Da) | 584.2985 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Aspergillus |
| ORIGIN SPECIES | fumigatus HNMF0047 |
| InChIKey | SFFUOHPMNZBGBA-QDYOCNNMSA-N |
| InChI | InChI=1S/C33H44O9/c1-16-21(36)13-14-31(6)23-11-10-20-25(19-9-12-24(30(4,5)39)42-29(19)38)22(40-17(2)34)15-32(20,7)33(23,8)28(37)27(26(16)31)41-18(3)35/h13-14,16,20,22-24,26-27,39H,9-12,15H2,1-8H3/b25-19-/t16-,20+,22+,23+,24+,26-,27+,31-,32+,33-/m1/s1 |
| SMILES | CC(=O)O[C@H]1C[C@@]2(C)[C@@H](CC[C@@H]3[C@]2(C)C(=O)[C@@H](OC(C)=O)[C@H]2[C@H](C)C(=O)C=C[C@@]23C)/C1=C1\CC[C@@H](C(C)(C)O)OC1=O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Kong, Fan-Dong; Huang, Xiao-Long; Ma, Qing-Yun; Xie, Qing-Yi; Wang, Pei; Chen, Peng-Wei; Zhou, Li-Man; Yuan, Jing-Zhe; Dai, Hao-Fu; Luo, Du-Qiang; Zhao, You-Xing Helvolic Acid Derivatives with Antibacterial Activities against Streptococcus agalactiae from the Marine-Derived Fungus Aspergillus fumigatus HNMF0047 Journal of Natural Products 2018 81 (8) 1869-1876. | ||
|---|---|---|---|
| DOI | 10.1021/acs.jnatprod.8b00382 | PMID | 30070829 |
