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Val-Cit-PAB-OH

CAT: 0399-CSB-DT2574Size: 1 gDry Ice: NoHazardous: No
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CAT#:0399-CSB-DT2574Size:1 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
159857-79-1
Purity
0.95
Form
Lyophilized powder
Molecular Formula
C18H29N5O4
Shipping Conditions
In general, amino acids are provided as lyophilized powder and are shipped with blue ice unless customers require otherwise.
Storage Conditions
Store at -20°C upon receipt, aliquoting is necessary for mutiple use. Avoid repeated freeze-thaw cycles. Short term: 4 °C, one week from the date of receipt. Long term: -20 °C to -80 °C, 6 months from the date of receipt.
Shelf Life
The shelf life is related to many factors, storage state, storage temperature and the stability of the product itself. Generally, the shelf life of lyophilized form is 6 months at -20°C/-80°C from the date of receipt.

Chemical Information

(2S)-5-((aminocarbonyl)amino)-2-(((2S)-2-amino-3-methylbutanoyl)amino)-N-(4-(hydroxymethyl)phenyl)pentanamide
CAS Number159857-79-1
PubChem CID54387473
IUPAC Name(2S)-2-[[(2S)-2-amino-3-methylbutanoyl]amino]-5-(carbamoylamino)-N-[4-(hydroxymethyl)phenyl]pentanamide
Molecular FormulaC18H29N5O4
Molecular Weight379.5
XLogP-0.5
Topological Polar Surface Area160
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count5
Rotatable Bond Count10
Heavy Atom Count27
Formal Charge0
Complexity492
SMILES
CC(C)[C@@H](C(=O)N[C@@H](CCCNC(=O)N)C(=O)NC1=CC=C(C=C1)CO)N
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
InChIKey
VEGGTWZUZGZKHY-GJZGRUSLSA-N
Chemical Structure
2D Structure
2D structure of (2S)-5-((aminocarbonyl)amino)-2-(((2S)-2-amino-3-methylbutanoyl)amino)-N-(4-(hydroxymethyl)phenyl)pentanamide
CAS: 159857-79-1
CID: 54387473
Formula: C18H29N5O4
MW: 379.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight379.5
XLogP3-0.5
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count5
Rotatable Bond Count10
Exact Mass379.22195442
Monoisotopic Mass379.22195442
Topological Polar Surface Area160 Ų
Heavy Atom Count27
Formal Charge0
Complexity492
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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