Home Carboxys (2S)-2-amino-4-{[(1R)-1-[(carboxymethyl)carbamoyl]-2-sulfanylethyl]carbamoyl}butanoic acid

(2S)-2-amino-4-{[(1R)-1-[(carboxymethyl)carbamoyl]-2-sulfanylethyl]carbamoyl}butanoic acid

CAS No.:
70-18-8
Catalog Number:
AG006BC6
Molecular Formula:
C10H17N3O6S
Molecular Weight:
307.3235
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$13
- +
5g
98%
In Stock USA
United States
$17
- +
25g
98%
In Stock USA
United States
$44
- +
100g
98%
In Stock USA
United States
$132
- +
500g
98%
In Stock USA
United States
$469
- +
Product Description
Catalog Number:
AG006BC6
Chemical Name:
(2S)-2-amino-4-{[(1R)-1-[(carboxymethyl)carbamoyl]-2-sulfanylethyl]carbamoyl}butanoic acid
CAS Number:
70-18-8
Molecular Formula:
C10H17N3O6S
Molecular Weight:
307.3235
MDL Number:
MFCD00065939
IUPAC Name:
(2S)-2-amino-5-[[(2R)-1-(carboxymethylamino)-1-oxo-3-sulfanylpropan-2-yl]amino]-5-oxopentanoic acid
InChI:
InChI=1S/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/t5-,6-/m0/s1
InChI Key:
RWSXRVCMGQZWBV-WDSKDSINSA-N
SMILES:
SC[C@@H](C(=O)NCC(=O)O)NC(=O)CC[C@@H](C(=O)O)N
EC Number:
200-725-4
UNII:
GAN16C9B8O
NSC Number:
758199
Properties
Complexity:
389  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
307.084g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
6  
Isotope Atom Count:
0
Molecular Weight:
307.321g/mol
Monoisotopic Mass:
307.084g/mol
Rotatable Bond Count:
9  
Topological Polar Surface Area:
160A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-4.5  
Properties