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TCTDSTNCYKAT

CAT: 0804-HY-P3158-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-P3158-01Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
TCTDSTNCYKAT is an engineered-variant peptide of antifreeze protein (AFP) [1].
CAS Number
1621188-94-0
UNSPSC
12352209
Target
Others
Type
Peptides
Related Pathways
Others
Field of Research
Others
Assay Protocol
https://www.medchemexpress.com/tctdstncykat.html
Purity
98.44
Solubility
10 mM in DMSO
Smiles
OC(C=C1)=CC=C1C[C@H](NC([C@H](CS)NC([C@H](CC(N)=O)NC([C@H]([C@H](O)C)NC([C@H](CO)NC([C@H](CC(O)=O)NC([C@H]([C@H](O)C)NC([C@H](CS)NC([C@@H](N)[C@H](O)C)=O)=O)=O)=O)=O)=O)=O)=O)C(N[C@@H](CCCCN)C(N[C@@H](C)C(N[C@H](C(O)=O)[C@H](O)C)=O)=O)=O
Molecular Formula
C51H82N14O22S2
Molecular Weight
1307.41
References & Citations
[1]Zhaodi Jiang, et al. Genetically encoded tags for direct synthesis of EM-visible gold nanoparticles in cells. Nat Methods. 2020 Sep;17 (9) :937-946.
Shipping Conditions
Blue Ice
Storage Conditions
-80°C, 2 years; -20°C, 1 year (Powder, sealed storage, away from moisture and light, under nitrogen)
Scientific Category
Peptides
Clinical Information
No Development Reported

Chemical Information

Tctdstncykat
CAS Number1621188-94-0
PubChem CID162678837
IUPAC Name(3S)-4-[[(2S)-1-[[(2S,3R)-1-[[(2S)-4-amino-1-[[(2R)-1-[[(2S)-1-[[(2S)-6-amino-1-[[(2S)-1-[[(1S,2R)-1-carboxy-2-hydroxypropyl]amino]-1-oxopropan-2-yl]amino]-1-oxohexan-2-yl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-1-oxo-3-sulfanylpropan-2-yl]amino]-1,4-dioxobutan-2-yl]amino]-3-hydroxy-1-oxobutan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-3-[[(2S,3R)-2-[[(2R)-2-[[(2S,3R)-2-amino-3-hydroxybutanoyl]amino]-3-sulfanylpropanoyl]amino]-3-hydroxybutanoyl]amino]-4-oxobutanoic acid
Molecular FormulaC51H82N14O22S2
Molecular Weight1307.4
XLogP-13.1
Topological Polar Surface Area613
Hydrogen Bond Donor Count24
Hydrogen Bond Acceptor Count26
Rotatable Bond Count40
Heavy Atom Count89
Formal Charge0
Complexity2470
SMILES
C[C@H]([C@@H](C(=O)N[C@@H](CS)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)O)C(=O)O)N)O
InChI
InChI=1S/C51H82N14O22S2/c1-20(40(75)65-39(24(5)70)51(86)87)55-41(76)27(8-6-7-13-52)56-42(77)28(14-25-9-11-26(71)12-10-25)57-46(81)32(18-88)61-43(78)29(15-34(53)72)58-49(84)37(22(3)68)63-45(80)31(17-66)60-44(79)30(16-35(73)74)59-50(85)38(23(4)69)64-47(82)33(19-89)62-48(83)36(54)21(2)67/h9-12,20-24,27-33,36-39,66-71,88-89H,6-8,13-19,52,54H2,1-5H3,(H2,53,72)(H,55,76)(H,56,77)(H,57,81)(H,58,84)(H,59,85)(H,60,79)(H,61,78)(H,62,83)(H,63,80)(H,64,82)(H,65,75)(H,73,74)(H,86,87)/t20-,21+,22+,23+,24+,27-,28-,29-,30-,31-,32-,33-,36-,37-,38-,39-/m0/s1
InChIKey
ZBGONQTXYYTKRU-CTBJGBOQSA-N
Chemical Structure
2D Structure
2D structure of Tctdstncykat
CAS: 1621188-94-0
CID: 162678837
Formula: C51H82N14O22S2
MW: 1307.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight1307.4
XLogP3-13.1
Hydrogen Bond Donor Count24
Hydrogen Bond Acceptor Count26
Rotatable Bond Count40
Exact Mass1306.51695265
Monoisotopic Mass1306.51695265
Topological Polar Surface Area613 Ų
Heavy Atom Count89
Formal Charge0
Complexity2470
Isotope Atom Count0
Defined Atom Stereocenter Count16
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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