Molecule

2-[(1-{2-[2-(2-amino-3-phenylpropanamido)-3-methylbutanamido]-3-(1H-imidazol-5-yl)propanoyl}pyrrolidin-2-yl)formamido]-4-(methylsulfanyl)butanoic acid

AlkaPlorer ID: AK177074

Synonym: None

IUPAC Name: 2-[[1-[2-[[2-[(2-amino-3-phenylpropanoyl)amino]-3-methylbutanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]pyrrolidine-2-carbonyl]amino]-4-methylsulfanylbutanoic acid

Structure

SMILES: CSCCC(N=C(O)C1CCCN1C(=O)C(CC1=CN=CN1)N=C(O)C(N=C(O)C(N)CC1=CC=CC=C1)C(C)C)C(=O)O

InChI: InChI=1S/C30H43N7O6S/c1-18(2)25(36-26(38)21(31)14-19-8-5-4-6-9-19)28(40)35-23(15-20-16-32-17-33-20)29(41)37-12-7-10-24(37)27(39)34-22(30(42)43)11-13-44-3/h4-6,8-9,16-18,21-25H,7,10-15,31H2,1-3H3,(H,32,33)(H,34,39)(H,35,40)(H,36,38)(H,42,43)

InChIKey: KAGLXKGYCVVGHA-UHFFFAOYSA-N

Reference

Peptides from the Skin Glands of the Australian Buzzing Tree Frog Litoria electrica. Comparison with the Skin Peptides of the Red Tree Frog Litoria rubella

PubChem CID: 162901619

LOTUS: LTS0015692

COCONUT: CNP0169771

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Litoria electrica	Litoria	Hylidae	Anura	Amphibia	Chordata	Metazoa	Eukaryota

Properties Information

Molecule Weight: 629.7840000000002

TPSA？: 210.08

MolLogP？: 2.9822000000000024

Number of H-Donors: 6

Number of H-Acceptors: 8

RingCount: 3

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi