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Z-MAL

CAT: 0013-GTR19263774-02Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19263774-02Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Z-MAL is an efficient, broad-spectrum substrate for HDAC. It exhibits potent conversion activity for both Class I and II histone deacetylases as well as Class III SIRT1. Z-MAL is utilized in research focused on the structure-activity relationship, subtype selectivity, and inhibitor screening of HDAC.
CAS Number
642463-22-7
Field of Research
Epigenetics & Chromatin, Molecular Biology
Smiles
CC=1C=2C (=CC (NC ([C@@H] (NC (OCC3=CC=CC=C3) =O) CCCCNC (C) =O) =O) =CC2) OC (=O) C1
Molecular Formula
C26H29N3O6
Molecular Weight
479.53
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

(S)-Benzyl (6-acetamido-1-((4-methyl-2-oxo-2H-chromen-7-yl)amino)-1-oxohexan-2-yl)carbamate
CAS Number642463-22-7
PubChem CID10435243
IUPAC Namebenzyl N-[(2S)-6-acetamido-1-[(4-methyl-2-oxochromen-7-yl)amino]-1-oxohexan-2-yl]carbamate
Molecular FormulaC26H29N3O6
Molecular Weight479.5
XLogP2.7
Topological Polar Surface Area123
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count11
Heavy Atom Count35
Formal Charge0
Complexity792
SMILES
CC1=CC(=O)OC2=C1C=CC(=C2)NC(=O)[C@H](CCCCNC(=O)C)NC(=O)OCC3=CC=CC=C3
InChI
InChI=1S/C26H29N3O6/c1-17-14-24(31)35-23-15-20(11-12-21(17)23)28-25(32)22(10-6-7-13-27-18(2)30)29-26(33)34-16-19-8-4-3-5-9-19/h3-5,8-9,11-12,14-15,22H,6-7,10,13,16H2,1-2H3,(H,27,30)(H,28,32)(H,29,33)/t22-/m0/s1
InChIKey
QPYCOBUGIVWEDU-QFIPXVFZSA-N
Chemical Structure
2D Structure
2D structure of (S)-Benzyl (6-acetamido-1-((4-methyl-2-oxo-2H-chromen-7-yl)amino)-1-oxohexan-2-yl)carbamate
CAS: 642463-22-7
CID: 10435243
Formula: C26H29N3O6
MW: 479.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight479.5
XLogP32.7
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count11
Exact Mass479.20563565
Monoisotopic Mass479.20563565
Topological Polar Surface Area123 Ų
Heavy Atom Count35
Formal Charge0
Complexity792
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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