Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA022358
PROPERTIES
| NPAID | NPA022358 |
|---|---|
| CLUSTER ID | 6890 |
| NODE ID | 4761 |
| NAME | Ochracene H |
| FORMULA | C14H20O3 |
| MOLECULAR WEIGHT (Da) | 236.3110 |
| ACCURATE MASS (Da) | 236.1412 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Aspergillus |
| ORIGIN SPECIES | ochraceopetaliformis |
| InChIKey | MZLPVRHRFDXNNU-MRCXROJRSA-N |
| InChI | InChI=1S/C14H20O3/c1-9-6-7-14(2)10(4-3-5-12(14)15)8-11(9)13(16)17/h4,8-9,12,15H,3,5-7H2,1-2H3,(H,16,17)/t9-,12+,14+/m0/s1 |
| SMILES | C[C@H]1CC[C@]2([C@@H](CCC=C2C=C1C(=O)O)O)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Wang, Junfeng; He, Weijun; Kong, Fandong; Tian, Xinpeng; Wang, Pei; Zhou, Xiaojiang; Liu, Yonghong Ochracenes A-I, Humulane-Derived Sesquiterpenoids from the Antarctic Fungus Aspergillus ochraceopetaliformis Journal of Natural Products 2017 80 (6) 1725-1733. | ||
|---|---|---|---|
| DOI | 10.1021/acs.jnatprod.6b00810 | PMID | 28598633 |
