Home Carboxys (2S,4R)-1-((S)-2-(cyclopentyloxycarbonyl)-3,3-diMethylbutanoyl)-4-hydroxypyrrolidine-2-carboxylic acid

(2S,4R)-1-((S)-2-(cyclopentyloxycarbonyl)-3,3-diMethylbutanoyl)-4-hydroxypyrrolidine-2-carboxylic acid

CAS No.:
877069-25-5
Catalog Number:
AG00H2U3
Molecular Formula:
C17H27NO6
Molecular Weight:
341.3994
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Product Description
Catalog Number:
AG00H2U3
Chemical Name:
(2S,4R)-1-((S)-2-(cyclopentyloxycarbonyl)-3,3-diMethylbutanoyl)-4-hydroxypyrrolidine-2-carboxylic acid
CAS Number:
877069-25-5
Molecular Formula:
C17H27NO6
Molecular Weight:
341.3994
MDL Number:
MFCD28125613
IUPAC Name:
(2S,4R)-1-[(2S)-2-cyclopentyloxycarbonyl-3,3-dimethylbutanoyl]-4-hydroxypyrrolidine-2-carboxylic acid
InChI:
InChI=1S/C17H27NO6/c1-17(2,3)13(16(23)24-11-6-4-5-7-11)14(20)18-9-10(19)8-12(18)15(21)22/h10-13,19H,4-9H2,1-3H3,(H,21,22)/t10-,12+,13+/m1/s1
InChI Key:
SDOGPIGJXDYBIY-WXHSDQCUSA-N
SMILES:
O[C@@H]1C[C@H](N(C1)C(=O)[C@H](C(C)(C)C)C(=O)OC1CCCC1)C(=O)O
Properties
Complexity:
506  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
3  
Defined Bond Stereocenter Count:
0
Exact Mass:
341.184g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
341.404g/mol
Monoisotopic Mass:
341.184g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties