Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA004901
PROPERTIES
| NPAID | NPA004901 |
|---|---|
| CLUSTER ID | 2474 |
| NODE ID | 415 |
| NAME | 12-epi-Fischerindole I isonitrile |
| FORMULA | C21H21ClN2 |
| MOLECULAR WEIGHT (Da) | 336.8660 |
| ACCURATE MASS (Da) | 336.1393 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Hapalosiphon |
| ORIGIN SPECIES | welwitschii |
| InChIKey | ZVBCZYGMKQOJFW-QDUSTFBWSA-N |
| InChI | InChI=1S/C21H21ClN2/c1-6-21(4)15(22)11-13-17(19(21)23-5)16-12-9-7-8-10-14(12)24-18(16)20(13,2)3/h6-10,13,15,24H,1,11H2,2-4H3/t13-,15+,21+/m0/s1 |
| SMILES | C[C@]1([C@@H](C[C@H]2C(=C1[N+]#[C-])C3=C(C2(C)C)NC4=CC=CC=C43)Cl)C=C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Stratmann, Klemens; Moore, Richard E.; Bonjouklian, Rosanne; Deeter, Jack B.; Patterson, Gregory M. L.; Shaffer, Stacey; Smith, Charles D.; Smitka, Tim A. Welwitindolinones, Unusual Alkaloids from the Blue-Green Algae Hapalosiphon welwitschii and Westiella intricata. Relationship to Fischerindoles and Hapalinodoles. Journal of the American Chemical Society 1994 116 (22) 9935-9942. | ||
|---|---|---|---|
| DOI | 10.1021/ja00101a015 | PMID | - |
