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189070-79-9 | L-Cysteine, N-(6-amino-1-oxohexyl)-S-nonyl-
CAS No: 189070-79-9 Catalog No: AG002HT7 MDL No:
Product Description
Catalog Number:
AG002HT7
Chemical Name:
L-Cysteine, N-(6-amino-1-oxohexyl)-S-nonyl-
CAS Number:
189070-79-9
Molecular Formula:
C18H36N2O3S
Molecular Weight:
360.5550
IUPAC Name:
(2R)-2-(6-aminohexanoylamino)-3-nonylsulfanylpropanoic acid
InChI:
InChI=1S/C18H36N2O3S/c1-2-3-4-5-6-7-11-14-24-15-16(18(22)23)20-17(21)12-9-8-10-13-19/h16H,2-15,19H2,1H3,(H,20,21)(H,22,23)/t16-/m0/s1
InChI Key:
ANCFDEAJOFEREV-INIZCTEOSA-N
SMILES:
CCCCCCCCCSC[C@@H](C(=O)O)NC(=O)CCCCCN
Properties
Complexity:
327
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
360.245g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
360.557g/mol
Monoisotopic Mass:
360.245g/mol
Rotatable Bond Count:
17
Topological Polar Surface Area:
118A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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