Home Carboxys (2Z)-7-{[(2R)-2-amino-2-carboxyethyl]sulfanyl}-2-{[(1S)-2,2-dimethylcyclopropyl]formamido}hept-2-enoic acid

(2Z)-7-{[(2R)-2-amino-2-carboxyethyl]sulfanyl}-2-{[(1S)-2,2-dimethylcyclopropyl]formamido}hept-2-enoic acid

CAS No.:
82009-34-5
Catalog Number:
AG00362Q
Molecular Formula:
C16H26N2O5S
Molecular Weight:
358.4530
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
>98%(HPLC)
In Stock USA
United States
$73
- +
10mg
>98%(HPLC)
In Stock USA
United States
$103
- +
1g
95%
In Stock USA
United States
$125
- +
5g
95%
In Stock USA
United States
$375
- +
Product Description
Catalog Number:
AG00362Q
Chemical Name:
(2Z)-7-{[(2R)-2-amino-2-carboxyethyl]sulfanyl}-2-{[(1S)-2,2-dimethylcyclopropyl]formamido}hept-2-enoic acid
CAS Number:
82009-34-5
Molecular Formula:
C16H26N2O5S
Molecular Weight:
358.4530
MDL Number:
MFCD00867379
IUPAC Name:
(Z)-7-[(2R)-2-amino-2-carboxyethyl]sulfanyl-2-[[(1S)-2,2-dimethylcyclopropanecarbonyl]amino]hept-2-enoic acid
InChI:
InChI=1S/C16H26N2O5S/c1-16(2)8-10(16)13(19)18-12(15(22)23)6-4-3-5-7-24-9-11(17)14(20)21/h6,10-11H,3-5,7-9,17H2,1-2H3,(H,18,19)(H,20,21)(H,22,23)/b12-6-/t10-,11+/m1/s1
InChI Key:
DHSUYTOATWAVLW-WFVMDLQDSA-N
SMILES:
OC(=O)[C@@H](CSCCCC/C=C(/C(=O)O)\NC(=O)[C@H]1CC1(C)C)N
EC Number:
279-875-8
UNII:
141A6AMN38
Properties
Complexity:
519  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
1  
Exact Mass:
358.156g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
358.453g/mol
Monoisotopic Mass:
358.156g/mol
Rotatable Bond Count:
11  
Topological Polar Surface Area:
155A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1  
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