Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA011219
PROPERTIES
| NPAID | NPA011219 |
|---|---|
| CLUSTER ID | 3729 |
| NODE ID | 2803 |
| NAME | 1-epi-paeciloketal B |
| FORMULA | C33H46O5 |
| MOLECULAR WEIGHT (Da) | 522.7260 |
| ACCURATE MASS (Da) | 522.3345 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Paecilomyces |
| ORIGIN SPECIES | variotii J08NF-1 |
| InChIKey | YJXIKBMODFDOQS-SAIUNTKASA-N |
| InChI | InChI=1S/C33H46O5/c1-4-6-8-10-12-14-20-28(34)25-18-16-22-30-26(25)24-33(37-30)31-27(19-17-21-29(31)35)32(36-3,38-33)23-15-13-11-9-7-5-2/h16-19,21-22,35H,4-15,20,23-24H2,1-3H3/t32-,33+/m1/s1 |
| SMILES | CCCCCCCCC(=O)C1=C2C[C@]3(C4=C(C=CC=C4O)[C@](O3)(CCCCCCCC)OC)OC2=CC=C1 |
ORIGINAL ISOLATION REFERENCE
| CITATION | Wang, Haibo; Hong, Jongki; Yin, Jun; Moon, Hyung Ryong; Liu, Yonghong; Wei, Xiaoyi; Oh, Dong-Chan; Jung, Jee H. Dimeric Octaketide Spiroketals from the Jellyfish-Derived Fungus Paecilomyces variotii J08NF-1 Journal of Natural Products 2015 78 (11) 2832-2836. | ||
|---|---|---|---|
| DOI | 10.1021/acs.jnatprod.5b00594 | PMID | 26562481 |
