Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA013112
PROPERTIES
| NPAID | NPA013112 |
|---|---|
| CLUSTER ID | 1489 |
| NODE ID | 1223 |
| NAME | Auxarthrol C |
| FORMULA | C16H16O9 |
| MOLECULAR WEIGHT (Da) | 352.2950 |
| ACCURATE MASS (Da) | 352.0794 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Stemphylium |
| ORIGIN SPECIES | sp. 33231 |
| InChIKey | IGQRNPSFVHAGKN-AQGHMYMLSA-N |
| InChI | InChI=1S/C16H16O9/c1-14(23)11(20)12(21)15-10(19)8-6(3-5(24-2)4-7(8)17)9(18)16(15,25-15)13(14)22/h3-4,11-13,17,20-23H,1-2H3/t11-,12-,13+,14-,15-,16+/m1/s1 |
| SMILES | C[C@]1([C@@H]([C@H]([C@]23C(=O)C4=C(C=C(C=C4C(=O)[C@@]2([C@H]1O)O3)OC)O)O)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Zhou, Xue-Ming; Zheng, Cai-Juan; Chen, Guang-Ying; Song, Xiao-Ping; Han, Chang-Ri; Li, Gao-Nan; Fu, Yan-Hui; Chen, Wen-Hao; Niu, Zhi-Gang Bioactive Anthraquinone Derivatives from the Mangrove-Derived Fungus Stemphylium sp. 33231 Journal of Natural Products 2014 77 (9) 2021-2028. | ||
|---|---|---|---|
| DOI | 10.1021/np500340y | PMID | 25136754 |
