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206058-60-8 | L-Cysteine, L-cysteinyl-L-cysteinyl-
CAS No: 206058-60-8 Catalog No: AG002AHY MDL No:
Product Description
Catalog Number:
AG002AHY
Chemical Name:
L-Cysteine, L-cysteinyl-L-cysteinyl-
CAS Number:
206058-60-8
Molecular Formula:
C9H17N3O4S3
Molecular Weight:
327.4440
IUPAC Name:
(2R)-2-[[(2R)-2-[[(2R)-2-amino-3-sulfanylpropanoyl]amino]-3-sulfanylpropanoyl]amino]-3-sulfanylpropanoic acid
InChI:
InChI=1S/C9H17N3O4S3/c10-4(1-17)7(13)11-5(2-18)8(14)12-6(3-19)9(15)16/h4-6,17-19H,1-3,10H2,(H,11,13)(H,12,14)(H,15,16)/t4-,5-,6-/m0/s1
InChI Key:
SMYXEYRYCLIPIL-ZLUOBGJFSA-N
SMILES:
SC[C@@H](C(=O)N[C@H](C(=O)O)CS)NC(=O)[C@H](CS)N
Properties
Complexity:
343
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
327.038g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
7
Isotope Atom Count:
0
Molecular Weight:
327.432g/mol
Monoisotopic Mass:
327.038g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
125A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-3.7
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