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179034-18-5 | L-Cysteine, L-lysylglycyl-
CAS No: 179034-18-5 Catalog No: AG0026QB MDL No:
Product Description
Catalog Number:
AG0026QB
Chemical Name:
L-Cysteine, L-lysylglycyl-
CAS Number:
179034-18-5
Molecular Formula:
C11H22N4O4S
Molecular Weight:
306.3818
IUPAC Name:
(2R)-2-[[2-[[(2S)-2,6-diaminohexanoyl]amino]acetyl]amino]-3-sulfanylpropanoic acid
InChI:
InChI=1S/C11H22N4O4S/c12-4-2-1-3-7(13)10(17)14-5-9(16)15-8(6-20)11(18)19/h7-8,20H,1-6,12-13H2,(H,14,17)(H,15,16)(H,18,19)/t7-,8-/m0/s1
InChI Key:
DKTNGXVSCZULPO-YUMQZZPRSA-N
SMILES:
NCCCC[C@@H](C(=O)NCC(=O)N[C@H](C(=O)O)CS)N
Properties
Complexity:
340
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
306.136g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
6
Isotope Atom Count:
0
Molecular Weight:
306.381g/mol
Monoisotopic Mass:
306.136g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
149A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-4.2
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