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 | C21H32O4 |
| Molecular Weight | 348.48 g/mol |
| Exact Mass | 348.2301 Da |
| InChI |
InChI=1S/C21H32O4/c1-12(2)19-15-8-17(22)13(3)14-6-7-21(24,11-25-5)16(14)9-20(15,4)10-18(19)23/h9,12-14,17,22,24H,6-8,10-11H2,1-5H3/b16-9+/t13-,14+,17+,20+,21+/m1/s1
|
| InChIKey |
UFGRMUDXNJXKQF-BCAUTJFVSA-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)O
|
| Number of Atoms | 57 |
| Number of H-Bond Acceptors | 4 |
| Number of H-Bond Donors | 2 |
| Atoms in the Largest π-System | 4 |
| XLogP | 1.1 |
