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190732-18-4 | L-Serinamide, N-(11-amino-1-oxoundecyl)-L-seryl-L-lysyl-L-leucyl- (9CI)
CAS No: 190732-18-4 Catalog No: AG002ERI MDL No:
Product Description
Catalog Number:
AG002ERI
Chemical Name:
L-Serinamide, N-(11-amino-1-oxoundecyl)-L-seryl-L-lysyl-L-leucyl- (9CI)
CAS Number:
190732-18-4
Molecular Formula:
C29H57N7O7
Molecular Weight:
615.8056
IUPAC Name:
11-amino-N-[(2S)-1-[[(2S)-6-amino-1-[[(2S)-1-[[(2S)-1-amino-3-hydroxy-1-oxopropan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-oxohexan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]undecanamide
InChI:
InChI=1S/C29H57N7O7/c1-20(2)17-22(28(42)36-23(18-37)26(32)40)35-27(41)21(13-10-12-16-31)34-29(43)24(19-38)33-25(39)14-9-7-5-3-4-6-8-11-15-30/h20-24,37-38H,3-19,30-31H2,1-2H3,(H2,32,40)(H,33,39)(H,34,43)(H,35,41)(H,36,42)/t21-,22-,23-,24-/m0/s1
InChI Key:
NYJZEDMFLXXNRP-ZJZGAYNASA-N
SMILES:
NCCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)CO)CC(C)C)NC(=O)[C@@H](NC(=O)CCCCCCCCCCN)CO
Properties
Complexity:
829
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
4
Defined Bond Stereocenter Count:
0
Exact Mass:
615.432g/mol
Formal Charge:
0
Heavy Atom Count:
43
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
9
Isotope Atom Count:
0
Molecular Weight:
615.817g/mol
Monoisotopic Mass:
615.432g/mol
Rotatable Bond Count:
26
Topological Polar Surface Area:
252A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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