Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA033183
PROPERTIES
| NPAID | NPA033183 |
|---|---|
| CLUSTER ID | 3448 |
| NODE ID | 2606 |
| NAME | Hancockiamide E |
| FORMULA | C31H34N2O7 |
| MOLECULAR WEIGHT (Da) | 546.6200 |
| ACCURATE MASS (Da) | 546.2366 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Aspergillus |
| ORIGIN SPECIES | hancockii |
| InChIKey | DEAWAXPRULDTJW-AUDJJSHHSA-N |
| InChI | InChI=1S/C31H34N2O7/c1-36-25-13-22(14-26(37-2)30(25)35)12-24-17-32-23(11-21-15-27(38-3)31-28(16-21)39-19-40-31)18-33(24)29(34)10-9-20-7-5-4-6-8-20/h4-10,13-16,23-24,32,35H,11-12,17-19H2,1-3H3/b10-9+/t23-,24-/m0/s1 |
| SMILES | COC1=CC(C[C@H]2CN[C@@H](CC3=CC4=C(OCO4)C(OC)=C3)CN2C(=O)/C=C/C2=CC=CC=C2)=CC(OC)=C1O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Li, Hang; Lacey, Alastair E; Shu, Si; Kalaitzis, John A; Vuong, Daniel; Crombie, Andrew; Hu, Jinyu; Gilchrist, Cameron L M; Lacey, Ernest; Piggott, Andrew M; Chooi, Yit-Heng Hancockiamides: phenylpropanoid piperazines from Aspergillus hancockii are biosynthesised by a versatile dual single-module NRPS pathway. Organic & Biomolecular Chemistry 2021 19 (3) 587-595. | ||
|---|---|---|---|
| DOI | 10.1039/d0ob02243h | PMID | 33242032 |
