Gludapcin

(2R,6R)-2-amino-6-[[4-carboxy-4-[[(2S)-2-[[(2R)-2-hydroxypropanoyl]amino]propanoyl]amino]butanoyl]amino]-7-(carboxymethylamino)-7-oxoheptanoic acid

Also Known As: Gludapcin|Gludapein|FK-156|FK 156|FK 156, (D)(R)-isomer|SID:53786973|D-Lactyl-L-alanyl-alpha-glutamyl-(L)-meso-diaminopimelyl-(L)-glycine|Glycine, N-(2-hydroxy-1-oxopropyl)-L-alanyl-D-gamma-glutamyl-L-erythro-alpha,epsilon-diaminopimelyl-, (R)-|(2R,6R)-2-amino-6-[[4-carboxy-4-[[(2S)-2-[[(2R)-2-hydroxypropanoyl]amino]propanoyl]amino]butanoyl]amino]-7-(carboxymethylamino)-7-oxoheptanoic acid|Glycine, N-(2-hydroxy-1-oxopropyl)-L-alanyl-D-gamma-glutamyl-meso-alpha,epsilon-diaminopimelyl-, (R)-|(2R,6R)-2-amino-6-((4-carboxy-4-(((2S)-2-(((2R)-2-hydroxypropanoyl)amino)propanoyl)amino)butanoyl)amino)-7-(carboxymethylamino)-7-oxoheptanoic acid|(2R,6R)-2-Amino-6-[(4-carboxy-4-{[(2S)-2-{[(2R)-1,2-dihydroxypropylidene]amino}-1-hydroxypropylidene]amino}-1-hydroxybutylidene)amino]-7-[(carboxymethyl)imino]-7-hydroxyheptanoic acid|(2R,6R)-2-amino-7-(carboxymethylamino)-6-[[5-hydroxy-4-[[(2S)-2-[[(2R)-2-hydroxypropanoyl]amino]propanoyl]amino]-5-oxopentanoyl]amino]-7-oxoheptanoic acid|2-Amino-6-{[4-carboxy-4-({2-[(1,2-dihydroxypropylidene)amino]-1-hydroxypropylidene}amino)-1-hydroxybutylidene]amino}-7-[(carboxymethyl)imino]-7-hydroxyheptanoic acid|n-[(2r)-2-hydroxypropanoyl]-l-alanyl-n-{(2r,6r)-6-amino-6-carboxy-1-[(carboxymethyl)amino]-1-oxohexan-2-yl}glutamine

Molecular Formula	C20H33N5O11
Molecular Weight	519.21765 g/mol
LogP	-3.51
Topological Polar Surface Area	274.55 Ų
Hydrogen Bond Donors	9
Hydrogen Bond Acceptors	9
Rotatable Bonds	17
Exact Mass	519.21765
Heavy Atoms	36
Complexity	832.9

Chemical Identifiers

CAS Number	76490-22-7
SMILES	C[C@@H](C(=O)NC(CCC(=O)N[C@H](CCC[C@H](C(=O)O)N)C(=O)NCC(=O)O)C(=O)O)NC(=O)[C@@H](C)O