Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00000846211 | Gold | 1!CCMSLIB00000847370 |
| CCMSLIB00012134477 | Gold | 4 |
| CCMSLIB00012134475 | Gold | 4 |
| CCMSLIB00012134476 | Gold | 4 |
| CCMSLIB00009974274 | Gold | 4 |
| CCMSLIB00009974273 | Gold | 4 |
| CCMSLIB00009974272 | Gold | 4 |
COMPOUND NPA008767
PROPERTIES
| NPAID | NPA008767 |
|---|---|
| CLUSTER ID | 1134 |
| NODE ID | 969 |
| NAME | Cylindrol A4 |
| FORMULA | C28H39ClO6 |
| MOLECULAR WEIGHT (Da) | 507.0670 |
| ACCURATE MASS (Da) | 506.2435 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Cylindrocarpon |
| ORIGIN SPECIES | lucidum |
| InChIKey | CJUHWKPMXGYAGR-CVGSNDQKSA-N |
| InChI | InChI=1S/C28H39ClO6/c1-15(2)12-24(32)35-23(13-28(7)17(4)9-11-22(31)19(28)6)16(3)8-10-20-26(33)21(14-30)18(5)25(29)27(20)34/h8,14-15,17,19,23,33-34H,9-13H2,1-7H3/b16-8+/t17-,19+,23-,28+/m1/s1 |
| SMILES | C[C@@H]1CCC(=O)[C@@H]([C@@]1(C)C[C@H](/C(=C/CC2=C(C(=C(C(=C2O)Cl)C)C=O)O)/C)OC(=O)CC(C)C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Singh, Sheo B.; Ball, Richard G.; Bills, Gerald F.; Cascales, Carmen; Gibbs, Jackson B.; Goetz, Michael A.; Hoogsteen, Karst; Jenkins, Rosalind G.; Liesch, Jerrold M.; Lingham, Russell B.; Silverman, Keith C.; Zink, Deborah L. Chemistry and biology of cylindrols: Novel inhibitors of Ras farnesyl-protein transferase from Cylindrocarpon lucidum Journal of Organic Chemistry 1996 61 (22) 7727-7737. | ||
|---|---|---|---|
| DOI | 10.1021/jo961074p | PMID | 11667727 |
