N-{[(6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl)oxy]acetyl}alanyltryptophan
Chemical Structure Depiction of
N-{[(6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl)oxy]acetyl}alanyltryptophan
N-{[(6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl)oxy]acetyl}alanyltryptophan
Compound characteristics
| Compound ID: | Y040-8487 |
| Compound Name: | N-{[(6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl)oxy]acetyl}alanyltryptophan |
| Molecular Weight: | 531.57 |
| Molecular Formula: | C29 H29 N3 O7 |
| Smiles: | C[C@@H](C(N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O)=O)NC(COc1ccc2C3CCCCC=3C(=O)Oc2c1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.2986 |
| logD: | -1.3341 |
| logSw: | -2.9951 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 114.537 |
| InChI Key: | VIRHHEQMCQPPFZ-FYSMJZIKSA-N |