2-{6-amino-2-[(5-oxopyrrolidin-2-yl)formamido]hexanamido}-3-(1H-indol-3-yl)propanoic acid
AlkaPlorer ID: AK363454
Synonym: None
IUPAC Name: (2S)-2-[[(2S)-6-amino-2-[[(2S)-5-oxopyrrolidine-2-carbonyl]amino]hexanoyl]amino]-3-(1H-indol-3-yl)propanoic acid
Structure
SMILES: NCCCC[C@H](N=C(O)[C@@H]1CCC(O)=N1)C(O)=N[C@@H](CC1=CNC2=CC=CC=C12)C(=O)O
InChI: InChI=1S/C22H29N5O5/c23-10-4-3-7-16(26-21(30)17-8-9-19(28)25-17)20(29)27-18(22(31)32)11-13-12-24-15-6-2-1-5-14(13)15/h1-2,5-6,12,16-18,24H,3-4,7-11,23H2,(H,25,28)(H,26,30)(H,27,29)(H,31,32)/t16-,17-,18-/m0/s1
InChIKey: DDCLBYSFIHXSIU-BZSNNMDCSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Ovophis okinavensis | Ovophis | Viperidae | Squamata | Lepidosauria | Chordata | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 443.5040000000001
TPSA？: 176.88
MolLogP？: 2.693100000000001
Number of H-Donors: 6
Number of H-Acceptors: 5
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|