Glycylalanylprolylmethionylphenylalanylvalinamide; 4-L-Lysine analogue 

AlkaPlorer ID: AK049080

Synonym: Glycylalanylprolyllysylphenylalanylvalinamide, MIP-A2

IUPAC Name: 1-[2-[(2-aminoacetyl)amino]propanoyl]-N-[6-amino-1-[[1-[(1-amino-3-methyl-1-oxobutan-2-yl)amino]-1-oxo-3-phenylpropan-2-yl]amino]-1-oxohexan-2-yl]pyrrolidine-2-carboxamide

Structure

SMILES: CC(NC(=O)CN)C(=O)N1CCCC1C(=O)NC(CCCCN)C(=O)NC(CC1=CC=CC=C1)C(=O)NC(C(N)=O)C(C)C

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InChI: InChI=1S/C30H48N8O6/c1-18(2)25(26(33)40)37-28(42)22(16-20-10-5-4-6-11-20)36-27(41)21(12-7-8-14-31)35-29(43)23-13-9-15-38(23)30(44)19(3)34-24(39)17-32/h4-6,10-11,18-19,21-23,25H,7-9,12-17,31-32H2,1-3H3,(H2,33,40)(H,34,39)(H,35,43)(H,36,41)(H,37,42)

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InChIKey: TXFHCXHKPWWWQX-UHFFFAOYSA-N

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Reference

PubChem CID: 85650184

COCONUT: CNP0323656

Properties Information

Molecule Weight: 616.7640000000002

TPSA: 231.84

MolLogP: -1.591799999999992

Number of H-Donors: 7

Number of H-Acceptors: 8

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information