Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA021549
PROPERTIES
| NPAID | NPA021549 |
|---|---|
| CLUSTER ID | 6687 |
| NODE ID | 390 |
| NAME | Allocyclinone C |
| FORMULA | C24H16Cl2O8 |
| MOLECULAR WEIGHT (Da) | 503.2900 |
| ACCURATE MASS (Da) | 502.0222 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Actinoallomurus |
| ORIGIN SPECIES | sp. |
| InChIKey | HHNCNWIXXAQVNZ-UHFFFAOYSA-N |
| InChI | InChI=1S/C24H16Cl2O8/c1-24(33-3)16-15(23(31)34-24)20(29)14-13(21(16)30)18(27)10-5-4-8-6-9(7-25)17(26)22(32-2)11(8)12(10)19(14)28/h4-6,29-30H,7H2,1-3H3 |
| SMILES | CC1(C2=C(C3=C(C(=C2C(=O)O1)O)C(=O)C4=C(C3=O)C=CC5=CC(=C(C(=C54)OC)Cl)CCl)O)OC |
ORIGINAL ISOLATION REFERENCE
| CITATION | Cruz, Joao C S; Maffioli, Sonia I; Bernasconi, Alice; Brunati, Cristina; Gaspari, Eleonora; Sosio, Margherita; Wellington, Elizabeth; Donadio, Stefano Allocyclinones, hyperchlorinated angucyclinones from Actinoallomurus Journal of Antibiotics 2017 70 (1) 73-78. | ||
|---|---|---|---|
| DOI | 10.1038/ja.2016.62 | PMID | 27220409 |
