Home Other Building Blocks Val-cit-pab-oh

Val-cit-pab-oh

CAS No.:
159857-79-1
Catalog Number:
AG001RG1
Molecular Formula:
C18H29N5O4
Molecular Weight:
379.4540
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
500mg
95%
In Stock USA
United States
$422
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Product Description
Catalog Number:
AG001RG1
Chemical Name:
Val-cit-pab-oh
CAS Number:
159857-79-1
Molecular Formula:
C18H29N5O4
Molecular Weight:
379.4540
MDL Number:
MFCD22381209
IUPAC Name:
(2S)-2-[[(2S)-2-amino-3-methylbutanoyl]amino]-5-(carbamoylamino)-N-[4-(hydroxymethyl)phenyl]pentanamide
InChI:
InChI=1S/C18H29N5O4/c1-11(2)15(19)17(26)23-14(4-3-9-21-18(20)27)16(25)22-13-7-5-12(10-24)6-8-13/h5-8,11,14-15,24H,3-4,9-10,19H2,1-2H3,(H,22,25)(H,23,26)(H3,20,21,27)/t14-,15-/m0/s1
InChI Key:
VEGGTWZUZGZKHY-GJZGRUSLSA-N
SMILES:
OCc1ccc(cc1)NC(=O)[C@@H](NC(=O)[C@H](C(C)C)N)CCCNC(=O)N
Properties
Complexity:
492  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
379.222g/mol
Formal Charge:
0
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
6  
Isotope Atom Count:
0
Molecular Weight:
379.461g/mol
Monoisotopic Mass:
379.222g/mol
Rotatable Bond Count:
10  
Topological Polar Surface Area:
160A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5  
Properties