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13726-69-7 | Boc-L-Hydroxyproline
CAS No: 13726-69-7 Catalog No: AG0034K2 MDL No:MFCD00053370
Product Description
Catalog Number:
AG0034K2
Chemical Name:
Boc-L-Hydroxyproline
CAS Number:
13726-69-7
Molecular Formula:
C10H17NO5
Molecular Weight:
231.2457
MDL Number:
MFCD00053370
IUPAC Name:
(2S,4R)-4-hydroxy-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid
InChI:
InChI=1S/C10H17NO5/c1-10(2,3)16-9(15)11-5-6(12)4-7(11)8(13)14/h6-7,12H,4-5H2,1-3H3,(H,13,14)/t6-,7+/m1/s1
InChI Key:
BENKAPCDIOILGV-RQJHMYQMSA-N
SMILES:
O[C@H]1CN([C@@H](C1)C(=O)O)C(=O)OC(C)(C)C
EC Number:
604-011-7
UNII:
RC99P5B8IG
Properties
Complexity:
296
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
231.111g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
231.248g/mol
Monoisotopic Mass:
231.111g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
87.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
Literature
| Title | Journal |
|---|---|
| Selective irreversible inhibition of a protease by targeting a noncatalytic cysteine. | Nature chemical biology 20110101 |
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