Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA014688
PROPERTIES
| NPAID | NPA014688 |
|---|---|
| CLUSTER ID | 5208 |
| NODE ID | 1017 |
| NAME | Thiersindole C |
| FORMULA | C28H39NO |
| MOLECULAR WEIGHT (Da) | 405.6260 |
| ACCURATE MASS (Da) | 405.3032 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Penicillium |
| ORIGIN SPECIES | thiersii |
| InChIKey | OCYNSSRIJRLWML-QGQKXLEHSA-N |
| InChI | InChI=1S/C28H39NO/c1-19(2)9-8-16-27(4)23-13-12-20(3)28(5,24(23)14-15-26(27)30)17-21-18-29-25-11-7-6-10-22(21)25/h6-7,9-11,18,20,26,29-30H,8,12-17H2,1-5H3/t20-,26-,27-,28+/m0/s1 |
| SMILES | C[C@H]1CCC2=C([C@]1(C)CC3=CNC4=CC=CC=C43)CC[C@@H]([C@@]2(C)CCC=C(C)C)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Li, Chen; Gloer, James B.; Wicklow, Donald T. Thiersindoles A-C: New indole diterpenoids from Penicillium thiersii Journal of Natural Products 2003 66 (9) 1232-1235. | ||
|---|---|---|---|
| DOI | 10.1021/np030192m | PMID | 14510604 |
