N-[rel-(7R)-7-acetamido-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]valine
Chemical Structure Depiction of
N-[rel-(7R)-7-acetamido-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]valine
N-[rel-(7R)-7-acetamido-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]valine
Compound characteristics
| Compound ID: | Y041-7400 |
| Compound Name: | N-[rel-(7R)-7-acetamido-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]valine |
| Molecular Weight: | 484.55 |
| Molecular Formula: | C26 H32 N2 O7 |
| Smiles: | CC(C)[C@@H](C(O)=O)NC1=CC=C2C(=CC1=O)[C@H](CCc1cc(c(c(c12)OC)OC)OC)NC(C)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.7502 |
| logD: | -2.0761 |
| logSw: | -1.5294 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 100.791 |
| InChI Key: | JZDLAUSYEAFGDD-MBSDFSHPSA-N |