Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00004685109 | Bronze | 2,4-dihydroxy-6-methyl-3-[(2E,4E)-3-methyl-5-[(1R,2R,6R)-1,2,6-trimethyl-3-oxocyclohexyl]penta-2,4-dienyl]benzaldehyde |
| CCMSLIB00004685110 | Bronze | 2,4-dihydroxy-6-methyl-3-[(2E,4E)-3-methyl-5-[(1R,2R,6R)-1,2,6-trimethyl-3-oxocyclohexyl]penta-2,4-dienyl]benzaldehyde |
| CCMSLIB00004685111 | Bronze | 2,4-dihydroxy-6-methyl-3-[(2E,4E)-3-methyl-5-[(1R,2R,6R)-1,2,6-trimethyl-3-oxocyclohexyl]penta-2,4-dienyl]benzaldehyde |
| CCMSLIB00004685112 | Bronze | 2,4-dihydroxy-6-methyl-3-[(2E,4E)-3-methyl-5-[(1R,2R,6R)-1,2,6-trimethyl-3-oxocyclohexyl]penta-2,4-dienyl]benzaldehyde |
| CCMSLIB00000846934 | Gold | 1!CCMSLIB00000846936 |
| CCMSLIB00005722577 | Gold | 3 |
| CCMSLIB00005722578 | Gold | 3 |
| CCMSLIB00005722580 | Gold | 3 |
| CCMSLIB00005722579 | Gold | 3 |
| CCMSLIB00012130774 | Gold | 4 |
| CCMSLIB00012130773 | Gold | 4 |
| CCMSLIB00012130775 | Gold | 4 |
| CCMSLIB00009970571 | Gold | 4 |
| CCMSLIB00009970570 | Gold | 4 |
| CCMSLIB00009970572 | Gold | 4 |
| CCMSLIB00012130776 | Gold | 4 |
| CCMSLIB00012130777 | Gold | 4 |
| CCMSLIB00009970573 | Gold | 4 |
| CCMSLIB00009970574 | Gold | 4 |
COMPOUND NPA016889
PROPERTIES
| NPAID | NPA016889 |
|---|---|
| CLUSTER ID | 1134 |
| NODE ID | 969 |
| NAME | Cylindrol B |
| FORMULA | C23H30O4 |
| MOLECULAR WEIGHT (Da) | 370.4890 |
| ACCURATE MASS (Da) | 370.2144 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Cylindrocarpon |
| ORIGIN SPECIES | lucidum |
| InChIKey | AQCKKGIVKOHRLM-HBFAXEOFSA-N |
| InChI | InChI=1S/C23H30O4/c1-14(10-11-23(5)16(3)7-9-20(25)17(23)4)6-8-18-21(26)12-15(2)19(13-24)22(18)27/h6,10-13,16-17,26-27H,7-9H2,1-5H3/b11-10+,14-6+/t16-,17+,23+/m1/s1 |
| SMILES | C[C@@H]1CCC(=O)[C@@H]([C@@]1(C)/C=C/C(=C/CC2=C(C=C(C(=C2O)C=O)C)O)/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 |
