Molecule

2-amino-N-(1-{2-[(1-{[1-carbamoyl-2-(4-hydroxyphenyl)ethyl]carbamoyl}-2-(1H-indol-3-yl)ethyl)carbamoyl]pyrrolidin-1-yl}-4-methyl-1-oxopentan-2-yl)-3-phenylpropanamide

AlkaPlorer ID: AK318357

Synonym: None

IUPAC Name: (2S)-N-[(2S)-1-[[(2S)-1-amino-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-1-[(2S)-2-[[(2S)-2-amino-3-phenylpropanoyl]amino]-4-methylpentanoyl]pyrrolidine-2-carboxamide

Structure

SMILES: CC(C)C[C@H](N=C(O)[C@@H](N)CC1=CC=CC=C1)C(=O)N1CCC[C@H]1C(O)=N[C@@H](CC1=CNC2=CC=CC=C12)C(O)=N[C@@H](CC1=CC=C(O)C=C1)C(=N)O

InChI: InChI=1S/C40H49N7O6/c1-24(2)19-34(46-37(50)30(41)20-25-9-4-3-5-10-25)40(53)47-18-8-13-35(47)39(52)45-33(22-27-23-43-31-12-7-6-11-29(27)31)38(51)44-32(36(42)49)21-26-14-16-28(48)17-15-26/h3-7,9-12,14-17,23-24,30,32-35,43,48H,8,13,18-22,41H2,1-2H3,(H2,42,49)(H,44,51)(H,45,52)(H,46,50)/t30-,32-,33-,34-,35-/m0/s1

InChIKey: DCJRUNSLGWAJNE-BLRSMAGHSA-N

Reference

The Structures of New Peptides From the Australian Red Tree Frog 'Litoria rubella'. The Skin Peptide Profile as a Probe for the Study of Evolutionary Trends of Amphibians

PubChem CID: 10395119

LOTUS: LTS0117955

NPASS: NPC108123

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Mycoleptodonoides aitchisonii	Mycoleptodonoides	None	Polyporales	Agaricomycetes	Basidiomycota	Fungi	Eukaryota

Properties Information

Molecule Weight: 723.8750000000002

TPSA？: 224.2

MolLogP？: 5.7763700000000044

Number of H-Donors: 8

Number of H-Acceptors: 7

RingCount: 5

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi