Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA033181
PROPERTIES
| NPAID | NPA033181 |
|---|---|
| CLUSTER ID | 3448 |
| NODE ID | 2606 |
| NAME | Hancockiamide C |
| FORMULA | C31H32N2O5 |
| MOLECULAR WEIGHT (Da) | 512.6060 |
| ACCURATE MASS (Da) | 512.2311 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Aspergillus |
| ORIGIN SPECIES | hancockii |
| InChIKey | RVLALFABWNVGIS-HKRYAFHYSA-N |
| InChI | InChI=1S/C31H32N2O5/c1-22(34)32-19-27(16-25-17-28(36-2)31-29(18-25)37-21-38-31)33(20-26(32)15-24-11-7-4-8-12-24)30(35)14-13-23-9-5-3-6-10-23/h3-14,17-18,26-27H,15-16,19-21H2,1-2H3/b14-13+/t26-,27-/m0/s1 |
| SMILES | COC1=CC(C[C@H]2CN(C(C)=O)[C@@H](CC3=CC=CC=C3)CN2C(=O)/C=C/C2=CC=CC=C2)=CC2=C1OCO2 |
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 |
