Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA001796
PROPERTIES
| NPAID | NPA001796 |
|---|---|
| CLUSTER ID | 1138 |
| NODE ID | 972 |
| NAME | (+)-Aristolochene |
| FORMULA | C15H24 |
| MOLECULAR WEIGHT (Da) | 204.3570 |
| ACCURATE MASS (Da) | 204.1878 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Penicillium |
| ORIGIN SPECIES | roqueforti |
| InChIKey | YONHOSLUBQJXPR-KCQAQPDRSA-N |
| InChI | InChI=1S/C15H24/c1-11(2)13-8-9-14-7-5-6-12(3)15(14,4)10-13/h9,12-13H,1,5-8,10H2,2-4H3/t12-,13-,15+/m0/s1 |
| SMILES | C[C@H]1CCCC2=CC[C@@H](C[C@]12C)C(=C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Demyttenaere, Jan C.R; Adams, An; Belleghem, Kristof Van; Kimpe, Norbert De; König, Wilfried A; Tkachev, Alexey V De novo production of (+)-aristolochene by sporulated surface cultures of Penicillium roqueforti Phytochemistry 2002 59 (6) 135-145. | ||
|---|---|---|---|
| DOI | 10.1007/bf00988641 | PMID | 24420433 |
