Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA016726
PROPERTIES
| NPAID | NPA016726 |
|---|---|
| CLUSTER ID | 18 |
| NODE ID | 18 |
| NAME | Chevalone E |
| FORMULA | C26H38O4 |
| MOLECULAR WEIGHT (Da) | 414.5860 |
| ACCURATE MASS (Da) | 414.2770 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Aspergillus |
| ORIGIN SPECIES | similanensis |
| InChIKey | PSHUZQHBLAPAMD-KFCOXGNHSA-N |
| InChI | InChI=1S/C26H38O4/c1-15-13-17(27)16-14-20-25(5)10-7-18-23(2,3)21(28)9-11-24(18,4)19(25)8-12-26(20,6)30-22(16)29-15/h13,18-21,28H,7-12,14H2,1-6H3/t18-,19+,20-,21-,24-,25+,26-/m0/s1 |
| SMILES | CC1=CC(=O)C2=C(O[C@@]3(C)CC[C@H]4[C@@](C)(CC[C@H]5C(C)(C)[C@@H](O)CC[C@@]54C)[C@@H]3C2)O1 |
ORIGINAL ISOLATION REFERENCE
| CITATION | Prompanya, Chadaporn; Dethoup, Tida; Bessa, Lucinda J.; Pinto, Madalena M. M.; Gales, Luís; Costa, Paulo M.; Silva, Artur M. S.; Kijjoa, Anake New isocoumarin derivatives and meroterpenoids from the marine sponge-associated fungus Aspergillus similanensis sp. Nov. KUFA 0013 Marine Drugs 2014 12 (10) 5160-5173. | ||
|---|---|---|---|
| DOI | 10.3390/md12105160 | PMID | 25317534 |
