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Ac-Pro-Ala-Leu-AMC

CAT: 0498-bs-75319C-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0498-bs-75319C-01Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1431362-79-6
Conjugation
Unconjugated
Purity
>97%
Buffer
Powder
Solubility
Soluble in DMSO.
Smiles
O=C(C)N1CCC[C@H]1C(N[C@@H](C)C(N[C@@H](CC(C)C)C(NC2=CC=C(C(C)=CC(O3)=O)C3=C2)=O)=O)=O
Molecular Formula
C26H34N4O6
Molecular Weight
498.6
Storage Conditions
Stable for 1 year after receipt when stored at -20°C.
Appearance
Lyophilized powder.

Chemical Information

Ac-PAL-AMC
CAS Number1431362-79-6
PubChem CID137700547
IUPAC Name(2S)-1-acetyl-N-[(2S)-1-[[(2S)-4-methyl-1-[(4-methyl-2-oxochromen-7-yl)amino]-1-oxopentan-2-yl]amino]-1-oxopropan-2-yl]pyrrolidine-2-carboxamide
Molecular FormulaC26H34N4O6
Molecular Weight498.6
XLogP1.9
Topological Polar Surface Area134
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count8
Heavy Atom Count36
Formal Charge0
Complexity916
SMILES
CC1=CC(=O)OC2=C1C=CC(=C2)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@@H]3CCCN3C(=O)C
InChI
InChI=1S/C26H34N4O6/c1-14(2)11-20(25(34)28-18-8-9-19-15(3)12-23(32)36-22(19)13-18)29-24(33)16(4)27-26(35)21-7-6-10-30(21)17(5)31/h8-9,12-14,16,20-21H,6-7,10-11H2,1-5H3,(H,27,35)(H,28,34)(H,29,33)/t16-,20-,21-/m0/s1
InChIKey
BWJPVHDZSJFFDM-NDXORKPFSA-N
Chemical Structure
2D Structure
2D structure of Ac-PAL-AMC
CAS: 1431362-79-6
CID: 137700547
Formula: C26H34N4O6
MW: 498.6
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight498.6
XLogP31.9
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count8
Exact Mass498.24783482
Monoisotopic Mass498.24783482
Topological Polar Surface Area134 Ų
Heavy Atom Count36
Formal Charge0
Complexity916
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes