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 | C33H62O3Si2 |
| Molecular Weight | 563.02 g/mol |
| Exact Mass | 562.4238 Da |
| InChI |
InChI=1S/C33H62O3Si2/c1-14-38(15-2,16-3)36-33(23-34-11)20-18-27-25(6)30(35-37(12,13)31(7,8)9)21-28-26(24(4)5)17-19-32(28,10)22-29(27)33/h22,24-25,27,30H,14-21,23H2,1-13H3/b29-22+/t25-,27+,30+,32-,33+/m1/s1
|
| InChIKey |
DYKGRIWUBQONOZ-AJBPWODOSA-N
|
| SMILES |
CC[Si](CC)(CC)O[C@@]\1(CC[C@@]/2([H])[C@@H](C)[C@H](CC3=C(CC[C@]3(C)/C=C21)C(C)C)O[Si](C)(C)C(C)(C)C)COC
|
| Number of Atoms | 100 |
| Number of H-Bond Acceptors | 3 |
| Number of H-Bond Donors | 0 |
| Atoms in the Largest π-System | 2 |
| XLogP | 9.2 |
