Heterologous biosynthesis of cotylenol and concise synthesis of fusicoccane diterpenoids
Ye Yuan, Zhenhua Guan, Xue-Jie Zhang, Nanyu Yao, Wenling Yuan, Yonghui Zhang, Ying Ye and Zheng Xiang
Beilstein J. Org. Chem. 2025, 21, 1489–1495.
https://doi.org/10.3762/bjoc.21.111
Chemical Information
Calculated using the Chemistry Development Kit 2.12
| Molecular Formula | C33H60O5Si2 |
| Molecular Weight | 593.00 g/mol |
| Exact Mass | 592.3979 Da |
| InChI |
InChI=1S/C33H60O5Si2/c1-14-40(15-2,16-3)38-33(21-36-11)18-17-24-23(6)27(37-39(12,13)31(7,8)9)19-25-28(22(4)5)29(34)30(35)32(25,10)20-26(24)33/h20,22-24,27,30,35H,14-19,21H2,1-13H3/b26-20+/t23-,24+,27+,30-,32-,33+/m1/s1
|
| InChIKey |
LLUJDHPWGWWGEX-WLMIOOCQSA-N
|
| SMILES |
CC[Si](CC)(CC)O[C@@]\1(CC[C@@]/2([H])[C@@H](C)[C@H](CC3=C(C(C)C)C(=O)[C@H]([C@]3(C)/C=C21)O)O[Si](C)(C)C(C)(C)C)COC
|
| Number of Atoms | 100 |
| Number of H-Bond Acceptors | 5 |
| Number of H-Bond Donors | 1 |
| Atoms in the Largest π-System | 4 |
| XLogP | 6.9 |
