Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA021550
PROPERTIES
| NPAID | NPA021550 |
|---|---|
| CLUSTER ID | 6687 |
| NODE ID | 390 |
| NAME | Allocyclinone D |
| FORMULA | C24H15Cl3O8 |
| MOLECULAR WEIGHT (Da) | 537.7350 |
| ACCURATE MASS (Da) | 535.9833 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Actinoallomurus |
| ORIGIN SPECIES | sp. |
| InChIKey | SWCJMEFTOZERMB-UHFFFAOYSA-N |
| InChI | InChI=1S/C24H15Cl3O8/c1-24(34-3)15-14(23(32)35-24)19(30)13-12(20(15)31)17(28)8-5-4-7-6-9(22(26)27)16(25)21(33-2)10(7)11(8)18(13)29/h4-6,22,30-31H,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)C(Cl)Cl)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 |
