Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA002562
PROPERTIES
| NPAID | NPA002562 |
|---|---|
| CLUSTER ID | 1514 |
| NODE ID | 1243 |
| NAME | Cyanosporaside A |
| FORMULA | C21H20ClNO6 |
| MOLECULAR WEIGHT (Da) | 417.8450 |
| ACCURATE MASS (Da) | 417.0979 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Salinispora |
| ORIGIN SPECIES | pacifica |
| InChIKey | FMQYEPDNLFRUQP-LPYYISIISA-N |
| InChI | InChI=1S/C21H20ClNO6/c1-10-20(2,27)18(26)17(25)19(28-10)29-21-13(5-6-14(21)24)9-12-4-3-11(7-8-23)16(22)15(12)21/h3-6,9-10,14,17,19,24-25,27H,7H2,1-2H3/t10-,14+,17-,19+,20+,21+/m1/s1 |
| SMILES | C[C@@H]1[C@](C(=O)[C@H]([C@@H](O1)O[C@]23[C@H](C=CC2=CC4=C3C(=C(C=C4)CC#N)Cl)O)O)(C)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Oh, Dong-Chan; Williams, Philip G; Kauffman, Christopher A; Jensen, Paul R; Fenical, William Cyanosporasides A and B, chloro- and cyano-cyclopenta[a]indene glycosides from the marine actinomycete "Salinispora pacifica" Organic Letters 2006 8 (6) 1021-1024. | ||
|---|---|---|---|
| DOI | 10.1021/ol052686b | PMID | 16524258 |
