| C00007322 - Coffea congensis | |
| C_ID | C00007322 |
| CAS RN | 23290-26-8 |
| Metabolite | delta7-Avenasterol |
| Molecular Formula | C29H48O |
| Organism | Coffea congensis |
| Kingdom | Plantae |
| Family | Rubiaceae |
| Genus | Coffea |
| SMILES | C1[C@@H](C[C@@H]2[C@](C1)([C@H]1C(=CC2)[C@@H]2[C@](CC1)([C@@H](CC2)[C@@H](CC/C(=C/C)/C(C)C)C)C)C)O |
| InChI | InChI=1S/C29H48O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h7,11,19-20,22-23,25-27,30H,8-10,12-18H2,1-6H3/b21-7-/t20-,22-,23+,25+,26-,27-,28+,29-/m1/s1 |
| InChIKey | MCWVPSBQQXUCTB-XQXVWGHCNA-N |
| Reference | Dussert,Phytochem.,69,(2008),2950 |
| Structural formula |  |