3-{[(tert-butoxy)carbonyl]amino}-4-(2,5-difluorophenyl)butanoic acid
AlkaPlorer ID: AK056139
Synonym: None
IUPAC Name: (3R)-4-(2,5-difluorophenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid
Structure
SMILES: CC(C)(C)OC(O)=N[C@@H](CC(=O)O)CC1=CC(F)=CC=C1F
InChI: InChI=1S/C15H19F2NO4/c1-15(2,3)22-14(21)18-11(8-13(19)20)7-9-6-10(16)4-5-12(9)17/h4-6,11H,7-8H2,1-3H3,(H,18,21)(H,19,20)/t11-/m1/s1
InChIKey: DYAISPAQPPRCQC-LLVKDONJSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Clematis chinensis | Clematis | Ranunculaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Angelica sinensis | Angelica | Apiaceae | Apiales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Prunus mume | Prunus | Rosaceae | Rosales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 315.316
TPSA？: 79.12
MolLogP？: 3.0797000000000008
Number of H-Donors: 2
Number of H-Acceptors: 3
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|