3-(2-amino-3-methylbutanamido)-3-{[1-({1-[(1-carboxyethyl)carbamoyl]-2-phenylethyl}carbamoyl)-2-phenylethyl]carbamoyl}propanoic acid

AlkaPlorer ID: AK194874

Synonym: None

IUPAC Name: 3-[(2-amino-3-methylbutanoyl)amino]-4-[[1-[[1-(1-carboxyethylamino)-1-oxo-3-phenylpropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-4-oxobutanoic acid

Structure

SMILES: CC(N=C(O)C(CC1=CC=CC=C1)N=C(O)C(CC1=CC=CC=C1)N=C(O)C(CC(=O)O)N=C(O)C(N)C(C)C)C(=O)O

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InChI: InChI=1S/C30H39N5O8/c1-17(2)25(31)29(41)35-23(16-24(36)37)28(40)34-22(15-20-12-8-5-9-13-20)27(39)33-21(14-19-10-6-4-7-11-19)26(38)32-18(3)30(42)43/h4-13,17-18,21-23,25H,14-16,31H2,1-3H3,(H,32,38)(H,33,39)(H,34,40)(H,35,41)(H,36,37)(H,42,43)

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InChIKey: SGZPJMYSPUDTGE-UHFFFAOYSA-N

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Source

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

Properties Information

Molecule Weight: 597.6690000000002

TPSA: 230.98

MolLogP: 3.3347000000000024

Number of H-Donors: 7

Number of H-Acceptors: 7

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information