TEMURTIDE

4-[[2-[2-[(3R,4R,5S,6R)-3-acetamido-2,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxypropanoylamino]-3-hydroxybutanoyl]amino]-5-amino-5-oxopentanoic acid

Also Known As: TEMURTIDE|AC1L2ITI|3-O-[1-({1-[(4-Carboxy-1-hydroxy-1-iminobutan-2-yl)imino]-1,3-dihydroxybutan-2-yl}imino)-1-hydroxypropan-2-yl]-2-deoxy-2-[(1-hydroxyethylidene)amino]hexopyranose|4-[[2-[2-[(3R,4R,5S,6R)-3-acetamido-2,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxypropanoylamino]-3-hydroxybutanoyl]amino]-5-amino-5-oxopentanoic acid|3-O-[1-({1-[(4-Carboxy-1-hydroxy-1-iminobutan-2-yl)imino]-1,3-dihydroxybutan-2-yl}imino)-1-hydroxypropan-2-yl]-2-deoxy-2-[(1-hydroxyethylidene)amino]-D-glucopyranose

Molecular Formula	C20H34N4O12
Molecular Weight	522.21735 g/mol
LogP	-4.96
Topological Polar Surface Area	267.07 Ų
Hydrogen Bond Donors	9
Hydrogen Bond Acceptors	11
Rotatable Bonds	13
Exact Mass	522.21735
Heavy Atoms	36
Complexity	809.6

Chemical Identifiers

CAS Number	66112-59-2
SMILES	CC(C(C(=O)NC(CCC(=O)O)C(=O)N)NC(=O)C(C)O[C@H]1[C@@H]([C@H](OC([C@@H]1NC(=O)C)O)CO)O)O