Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA011624
PROPERTIES
| NPAID | NPA011624 |
|---|---|
| CLUSTER ID | 1374 |
| NODE ID | 1156 |
| NAME | Peniciaculin B |
| FORMULA | C30H44O6 |
| MOLECULAR WEIGHT (Da) | 500.6760 |
| ACCURATE MASS (Da) | 500.3138 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Penicillium |
| ORIGIN SPECIES | aculeatum SD-321 |
| InChIKey | KNIRNRYVMBOJSZ-KYJUHHDHSA-N |
| InChI | InChI=1S/C30H44O6/c1-20(2)9-7-15-29(5,34)24-13-11-22(17-26(24)31)19-36-28(33)23-12-14-25(27(32)18-23)30(6,35)16-8-10-21(3)4/h11-14,17-18,20-21,31-32,34-35H,7-10,15-16,19H2,1-6H3/t29-,30-/m0/s1 |
| SMILES | CC(C)CCC[C@@](C)(C1=C(C=C(C=C1)COC(=O)C2=CC(=C(C=C2)[C@](C)(CCCC(C)C)O)O)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Li, Xiao-Dong; Li, Xiao-Ming; Xu, Gang-Ming; Zhang, Peng; Wang, Bin-Gui Antimicrobial Phenolic Bisabolanes and Related Derivatives from Penicillium aculeatum SD-321, a Deep Sea Sediment-Derived Fungus Journal of Natural Products 2015 78 (4) 844-849. | ||
|---|---|---|---|
| DOI | 10.1021/acs.jnatprod.5b00004 | PMID | 25763602 |
