Xenopsin

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Description

Xenopsin, a neurotensin-like octapeptide, Xenopsin is an inhibitor of Tetragastrin stimulated gastric acid secretion.

CAS Number

51827-01-1

Stability

≥ 2 years

Purity

>98% (HPLC)

Weight

980.16

Molecular Formula

C47H73N13O10

Notes

Research use only, not for human use.

Receptor

——

Chemical Information

Xenopsin

Xenopsin has been reported in Xenopus laevis with data available.

CAS Number	51827-01-1
PubChem CID	123946
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
Molecular Formula	C47H73N13O10
Molecular Weight	980.2
XLogP	-2
Topological Polar Surface Area	368
Hydrogen Bond Donor Count	12
Hydrogen Bond Acceptor Count	12
Rotatable Bond Count	28
Heavy Atom Count	70
Formal Charge	0
Complexity	1860

SMILES

CC[C@H](C)C(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

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

InChIKey

VVZLRNZUCNGJQY-UZMZHEFNSA-N

Chemical Structure

2D Structure

CAS: 51827-01-1

CID: 123946

Formula: C47H73N13O10

MW: 980.2

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	980.2
XLogP3	-2
Hydrogen Bond Donor Count	12
Hydrogen Bond Acceptor Count	12
Rotatable Bond Count	28
Exact Mass	979.56033558
Monoisotopic Mass	979.56033558
Topological Polar Surface Area	368 Å²
Heavy Atom Count	70
Formal Charge	0
Complexity	1860
Isotope Atom Count	0
Defined Atom Stereocenter Count	7
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Alternative Products

Catalog	Name
CCP1477-01	Xenopsin
5-02096	Xenopsin (XP)
350430	Xenopsin Peptide
MBS3611018-01	Xenopsin (2TFA)
HY-P0253A	Xenopsin (TFA)
T80377-01	Xenopsin precursor fragment
abx266031-01	Xenopsin (XP) Peptide

Xenopsin

Chemical Information

Alternative Products

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