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 | C27H48O3Si |
| Molecular Weight | 448.75 g/mol |
| Exact Mass | 448.3373 Da |
| InChI |
InChI=1S/C27H48O3Si/c1-18(2)20-11-13-26(7)16-23-21(12-14-27(23,28)17-29-8)19(3)24(15-22(20)26)30-31(9,10)25(4,5)6/h16,18-19,21,24,28H,11-15,17H2,1-10H3/b23-16+/t19-,21+,24+,26-,27+/m1/s1
|
| InChIKey |
COMMDGOYQMXUNX-FZVZJBSGSA-N
|
| SMILES |
CC(C)C1=C2C[C@@H]([C@H](C)[C@]/3([H])CC[C@](COC)(\C3=C\[C@@]2(C)CC1)O)O[Si](C)(C)C(C)(C)C
|
| Number of Atoms | 79 |
| Number of H-Bond Acceptors | 3 |
| Number of H-Bond Donors | 1 |
| Atoms in the Largest π-System | 2 |
| XLogP | 6.0 |
