Diprotin B
AlkaPlorer ID: AK023393
Synonym: None
IUPAC Name: (2S)-2-[[(2S)-1-[(2S)-2-amino-3-methylbutanoyl]pyrrolidine-2-carbonyl]amino]-4-methylpentanoic acid
Structure
SMILES: CC(C)C[C@H](N=C(O)[C@@H]1CCCN1C(=O)[C@@H](N)C(C)C)C(=O)O
InChI: InChI=1S/C16H29N3O4/c1-9(2)8-11(16(22)23)18-14(20)12-6-5-7-19(12)15(21)13(17)10(3)4/h9-13H,5-8,17H2,1-4H3,(H,18,20)(H,22,23)/t11-,12-,13-/m0/s1
InChIKey: NHXZRXLFOBFMDM-AVGNSLFASA-N
Reference
Diprotins A and B, inhibitors of dipeptidyl aminopeptidase IV, produced by bacteria.
PubChem CID: 146208
CAS: 90614-49-6
LOTUS: LTS0016524
{NPAtlas: NPA020917
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Cereus | Sagartiidae | Actiniaria | Anthozoa | Cnidaria | Metazoa | Eukaryota |
| None | Cereus | Sagartiidae | Actiniaria | Anthozoa | Cnidaria | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 327.425
TPSA？: 116.22
MolLogP？: 1.416500000000001
Number of H-Donors: 3
Number of H-Acceptors: 4
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | Solute carrier organic anion transporter family member 1B1 | Inhibition | 73.58 | % | 10.1124/mol.112.084152 |
| Homo sapiens | Solute carrier organic anion transporter family member 1B3 | Inhibition | 62.5 | % | 10.1124/mol.112.084152 |