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 | C21H34O4 |
| Molecular Weight | 350.49 g/mol |
| Exact Mass | 350.2457 Da |
| InChI |
InChI=1S/C21H34O4/c1-12(2)14-6-8-20(4)10-16-15(7-9-21(16,24)11-25-5)13(3)18(22)19(23)17(14)20/h10,12-13,15,18-19,22-24H,6-9,11H2,1-5H3/b16-10+/t13-,15+,18-,19-,20-,21+/m1/s1
|
| InChIKey |
AKKFAKCBIIOLLX-LQQINCHMSA-N
|
| SMILES |
CC(C)C1=C2[C@H]([C@@H]([C@H](C)[C@]/3([H])CC[C@](COC)(\C3=C\[C@@]2(C)CC1)O)O)O
|
| Number of Atoms | 59 |
| Number of H-Bond Acceptors | 4 |
| Number of H-Bond Donors | 3 |
| Atoms in the Largest π-System | 2 |
| XLogP | 2.1 |
