200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 114148-95-7
114148-95-7 | L-Isoleucine, L-isoleucyl-L-isoleucyl-
CAS No: 114148-95-7 Catalog No: AG000AOK MDL No:
Product Description
Catalog Number:
AG000AOK
Chemical Name:
L-Isoleucine, L-isoleucyl-L-isoleucyl-
CAS Number:
114148-95-7
Molecular Formula:
C18H35N3O4
Molecular Weight:
357.4882
IUPAC Name:
(2S,3S)-2-[[(2S,3S)-2-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]-3-methylpentanoyl]amino]-3-methylpentanoic acid
InChI:
InChI=1S/C18H35N3O4/c1-7-10(4)13(19)16(22)20-14(11(5)8-2)17(23)21-15(18(24)25)12(6)9-3/h10-15H,7-9,19H2,1-6H3,(H,20,22)(H,21,23)(H,24,25)/t10-,11-,12-,13-,14-,15-/m0/s1
InChI Key:
BBQABUDWDUKJMB-LZXPERKUSA-N
SMILES:
CC[C@@H]([C@@H](C(=O)N[C@@H]([C@H](CC)C)C(=O)O)NC(=O)[C@H]([C@H](CC)C)N)C
Properties
Complexity:
456
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
6
Defined Bond Stereocenter Count:
0
Exact Mass:
357.263g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
357.495g/mol
Monoisotopic Mass:
357.263g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
122A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.