Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA028592
PROPERTIES
| NPAID | NPA028592 |
|---|---|
| CLUSTER ID | 66 |
| NODE ID | 62 |
| NAME | Acremoxanthone D |
| FORMULA | C33H26O13 |
| MOLECULAR WEIGHT (Da) | 630.5580 |
| ACCURATE MASS (Da) | 630.1373 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Unknown-fungus |
| ORIGIN SPECIES | sp. |
| InChIKey | FCWZMGVJCVLDHZ-GMZZAYRWSA-N |
| InChI | InChI=1S/C33H26O13/c1-12-8-16-22(17(35)9-12)26(40)24-25(39)15-6-7-31(24,29(16)45-13(2)34)11-14-10-18(36)23-27(21(14)15)46-33(30(42)44-3)20(38)5-4-19(37)32(33,43)28(23)41/h4-10,15,20,29,35-36,38,40,43H,11H2,1-3H3/t15-,20-,29-,31-,32+,33-/m0/s1 |
| SMILES | COC(=O)[C@]12OC3=C4C(=CC(O)=C3C(=O)[C@]1(O)C(=O)C=C[C@@H]2O)C[C@@]12C=C[C@@H]4C(=O)C1=C(O)C1=C(C=C(C)C=C1O)[C@@H]2OC(C)=O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Ayers S; Graf TN; Adcock AF; Kroll DJ; Shen Q; Swanson SM; Matthew S; Carcache de Blanco EJ; Wani MC; Darveaux BA; Pearce CJ; Oberlies NH Cytotoxic xanthone-anthraquinone heterodimers from an unidentified fungus of the order Hypocreales (MSX 17022). Journal of Antibiotics 2012 65 (1) 3-8. | ||
|---|---|---|---|
| DOI | 10.1038/ja.2011.95 | PMID | 22068158 |
