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626-72-2 | L-Homocystine
CAS No: 626-72-2 Catalog No: AG00353G MDL No:MFCD00020391
Product Description
Catalog Number:
AG00353G
Chemical Name:
L-Homocystine
CAS Number:
626-72-2
Molecular Formula:
C8H16N2O4S2
Molecular Weight:
268.3536
MDL Number:
MFCD00020391
IUPAC Name:
(2S)-2-amino-4-[[(3S)-3-amino-3-carboxypropyl]disulfanyl]butanoic acid
InChI:
InChI=1S/C8H16N2O4S2/c9-5(7(11)12)1-3-15-16-4-2-6(10)8(13)14/h5-6H,1-4,9-10H2,(H,11,12)(H,13,14)/t5-,6-/m0/s1
InChI Key:
ZTVZLYBCZNMWCF-WDSKDSINSA-N
SMILES:
N[C@H](C(=O)O)CCSSCC[C@@H](C(=O)O)N
EC Number:
210-962-5
UNII:
804AS222UE
Properties
Complexity:
216
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
268.055g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
268.346g/mol
Monoisotopic Mass:
268.055g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
177A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-5.6
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