XENOPSIN

Iupac Name：(2S)-2-[[(3S)-2-[[(2S)-2-[[(2S)-1-[(2S)-2-[[(2S)-6-amino-2-[[2-[[(2S)-5-
oxopyrrolidine-2-carbonyl]amino]acetyl]amino]hexanoyl]amino]-5-
(diaminomethylideneamino)pentanoyl]pyrrolidine-2-carbonyl]amino]-3-(1H-
indol-3-yl)propanoyl]amino]-3-methylpentanoyl]amino]-4-methylpentanoic
acid

CAS No.: 51827-01-1

Molecular Weight：980.16362

Modify Date.: 2022-10-31 03:59

Request For Quotation

1. Names and Identifiers

1.1 Name: XENOPSIN
1.2 Synonyms: GLP-GLY-LYS-ARG-PRO-TRP-ILE-LEU PGLU-GLY-LYS-ARG-PRO-TRP-ILE-LEU PYR-GLY-LYS-ARG-PRO-TRP-ILE-LEU PYR-GLY-LYS-ARG-PRO-TRP-ILE-LEU-OH PYROGLU-GLY-LYS-ARG-PRO-TRP-ILE-LEU XENOPSIN Xenopsin(2TFA)

1.3 CAS No.: 51827-01-1

1.4 CID: 11766461

1.5 Molecular Formula: C47H73N13O10 (isomer)

1.6 Inchi: InChI=1S/C47H73N13O10/c1-5-27(4)39(44(67)58-35(46(69)70)22-26(2)3)59-42(65)34(23-28-24-52-30-13-7-6-12-29(28)30)57-43(66)36-16-11-21-60(36)45(68)33(15-10-20-51-47(49)50)56-41(64)31(14-8-9-19-48)55-38(62)25-53-40(63)32-17-18-37(61)54-32/h6-7,12-13,24,26-27,31-36,39,52H,5,8-11,14-23,25,48H2,1-4H3,(H,53,63)(H,54,61)(H,55,62)(H,56,64)(H,57,66)(H,58,67)(H,59,65)(H,69,70)(H4,49,50,51)/t27-,31-,32-,33-,34-,35-,36-,39-/m0/s1

1.7 InChkey: VVZLRNZUCNGJQY-KITDWFFGSA-N

1.8 Canonical Smiles: CCC(C)C(C(=O)NC(CC(C)C)C(=O)O)NC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)C3CCCN3C(=O)C(CCCN=C(N)N)NC(=O)C(CCCCN)NC(=O)CNC(=O)C4CCC(=O)N4

1.9 Isomers Smiles: CC[C@H](C)[C@@H](C(=O)N[C@@H](CC(C)C)C(=O)O)NC(=O)[C@H](CC1=CNC2=CC=CC=C21)NC(=O)[C@@H]3CCCN3C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@@H]4CCC(=O)N4

2. Properties

2.1 Density: 1.43

2.1 Boiling point: °Cat760mmHg

2.1 Refractive index: 1.664

2.1 Flash Point: °C

2.1 Precise Quality: 979.56000

2.1 PSA: 365.02000

2.1 logP: 3.59260

2.1 Solubility: 微溶 (5.2 g/L) (25 oC),

2.2 pKa: 3.41±0.10(Predicted)

2.3 StorageTemp: −20°C

3. Safety and Handling

3.1 WGK Germany: 3

4. MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

no data available

2.2 GHS label elements, including precautionary statements

Pictogram(s)	no data available
Signal word	no data available
Hazard statement(s)	no data available
Precautionary statement(s)
Prevention	no data available
Response	no data available
Storage	no data available
Disposal	no data available

2.3 Other hazards which do not result in classification

no data available

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5. Computational chemical data

Molecular Weight: 980.16362g/mol
Molecular Formula: C₄₇H₇₃N₁₃O₁₀
Compound Is Canonicalized: True
XLogP3-AA: -2
Exact Mass: 979.56033558
Monoisotopic Mass: 979.56033558
Complexity: 1860
Rotatable Bond Count: 28
Hydrogen Bond Donor Count: 12
Hydrogen Bond Acceptor Count: 12
Topological Polar Surface Area: 368
Heavy Atom Count: 70
Defined Atom Stereocenter Count: 8
Undefined Atom Stereocenter Count: 0
Defined Bond Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
Isotope Atom Count: 0
Covalently-Bonded Unit Count: 1
CACTVS Substructure Key Fingerprint: AAADcfB//AAAAAAAAAAAAAAAAAAAAWLFgAAwAAAAAAAAAFgB8AAAHgAQCAAADSjBngQ/yPPJkgCoAzX3fACCgCExAiAI2aG4ZJgKYPLAkbGUYAhklgDYyAeci8COgAAAAAACAAAAAAAAAAQAAAAAAAAAAA==

6. Recommended Suppliers

Global12SuppliersView all >>

Hui Chem Company Limited Audited Suppliers

Products:API, Pharmaceutical intermediates, photoelectronic Materials
Tel:86-21-60542966

Xenopsin

Purity:99%Packing: 200kg/bag FOB
Price: 1 USD/gram
Time: 2017/06/28

Inquire

Beijing HuameiHuli Biochem Ltd Audited Suppliers

Tel:010-86181995

L-Leucine,5-oxo-L-prolylglycyl-L-lysyl-L-arginyl-L-prolyl-L-tryptophyl-L-isoleucyl-

Purity:99%Packing: 200kg/bag FOB
Price:
Time: 2010/12/18

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BOC Sciences Manufacturer

Products:building blocks, synthetic intermediates, custom synthesis
Tel:1-631-4854226

XENOPSIN

Purity:99%Packing: 200kg/bag FOB
Price: Inquiry USD/gram
Time: 2016/03/29

Inquire

GL Biochem(Shanghai) Ltd Manufacturer

Products:custom peptides, catalogue peptides, pharmaceutical peptides, cosmetic peptides,monoclonal antibody, polyclonal antibody,FMOC-ARG(PBF)-OH,FMOC-LYS(ME.BOC)-OH
Tel:86-21-61263452

Xenopsin (XP)

Purity:99%Packing: 200kg/bag FOB
Price:
Time: 2016/04/14

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Hefei Bopeptide Biotechnology Co., Ltd. Manufacturer

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XENOPSIN

Purity:99%Packing: 200kg/bag FOB
Price:
Time: 2019/04/01

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