Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA001609
PROPERTIES
| NPAID | NPA001609 |
|---|---|
| CLUSTER ID | 1039 |
| NODE ID | 895 |
| NAME | Varioxepine A |
| FORMULA | C26H29N3O5 |
| MOLECULAR WEIGHT (Da) | 463.5340 |
| ACCURATE MASS (Da) | 463.2107 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Paecilomyces |
| ORIGIN SPECIES | variotii |
| InChIKey | PZRCCRWGGJKTKC-GZLQHJCCSA-N |
| InChI | InChI=1S/C26H29N3O5/c1-16(2)20-21-28-23-25(12-8-9-13-31-23)26(33-19(15-32-25)24(3,4)34-26)29(21)18(22(30)27-20)14-17-10-6-5-7-11-17/h5-13,16,18-19H,14-15H2,1-4H3,(H,27,30)/t18-,19+,25+,26-/m0/s1 |
| SMILES | CC(C)C1=C2N=C3[C@]4(C=CC=CO3)[C@]5(N2[C@H](C(=O)N1)CC6=CC=CC=C6)O[C@H](CO4)C(O5)(C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Zhang, Peng; Mandi, Attila; Li, Xiao-Ming; Du, Feng-Yu; Wang, Jia-Ning; Li, Xin; Kurtan, Tibor; Wang, Bin-Gui Varioxepine A, a 3H-oxepine-containing alkaloid with a new oxa-cage from the marine algal-derived endophytic fungus Paecilomyces variotii Organic Letters 2014 16 (18) 4834-4837. | ||
|---|---|---|---|
| DOI | 10.1021/ol502329k | PMID | 25167167 |
