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Litorin

CAT: 1601-CCP1292-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:1601-CCP1292-02Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Peptide to Litorin
CAS Number
55749-97-8
Structure Composition
PGlu-Gln-Trp-Ala-Val-Gly-His-Phe-Met-NH2
Applications
A bombesin-like nonapeptide from the skin of the Australian leptodactylid frog Litoria aurea inhibiting thyrotropin secretion in rats.
Purity
> 95%
Form
Lyophilized powder
Molecular Formula
C51H68N14O11S
Molecular Weight
1085.28
Storage Conditions
Shipped at 4°C. Store at -20°C for one year.
Light Source
Synthetic

Chemical Information

Litorin

Litorin has been reported in Litoria aurea with data available.

CAS Number55749-97-8
PubChem CID5486808
IUPAC Name(2S)-N-[(2S)-1-[[(2S)-1-[[(2S)-1-[[2-[[(2S)-1-[[(2S)-1-[[(2S)-1-amino-4-methylsulfanyl-1-oxobutan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-3-methyl-1-oxobutan-2-yl]amino]-1-oxopropan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-2-[[(2S)-5-oxopyrrolidine-2-carbonyl]amino]pentanediamide
Molecular FormulaC51H68N14O11S
Molecular Weight1085.2
XLogP-0.3
Topological Polar Surface Area418
Hydrogen Bond Donor Count13
Hydrogen Bond Acceptor Count13
Rotatable Bond Count30
Heavy Atom Count77
Formal Charge0
Complexity2100
SMILES
C[C@@H](C(=O)N[C@@H](C(C)C)C(=O)NCC(=O)N[C@@H](CC1=CN=CN1)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N[C@@H](CCSC)C(=O)N)NC(=O)[C@H](CC3=CNC4=CC=CC=C43)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@@H]5CCC(=O)N5
InChI
InChI=1S/C51H68N14O11S/c1-27(2)43(51(76)56-25-42(68)60-39(22-31-24-54-26-57-31)50(75)63-37(20-29-10-6-5-7-11-29)49(74)61-34(44(53)69)18-19-77-4)65-45(70)28(3)58-48(73)38(21-30-23-55-33-13-9-8-12-32(30)33)64-47(72)36(14-16-40(52)66)62-46(71)35-15-17-41(67)59-35/h5-13,23-24,26-28,34-39,43,55H,14-22,25H2,1-4H3,(H2,52,66)(H2,53,69)(H,54,57)(H,56,76)(H,58,73)(H,59,67)(H,60,68)(H,61,74)(H,62,71)(H,63,75)(H,64,72)(H,65,70)/t28-,34-,35-,36-,37-,38-,39-,43-/m0/s1
InChIKey
OHCNRADJYUSTIV-FPNHNIPFSA-N
Chemical Structure
2D Structure
2D structure of Litorin
CAS: 55749-97-8
CID: 5486808
Formula: C51H68N14O11S
MW: 1085.2
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight1085.2
XLogP3-0.3
Hydrogen Bond Donor Count13
Hydrogen Bond Acceptor Count13
Rotatable Bond Count30
Exact Mass1084.49127021
Monoisotopic Mass1084.49127021
Topological Polar Surface Area418 Ų
Heavy Atom Count77
Formal Charge0
Complexity2100
Isotope Atom Count0
Defined Atom Stereocenter Count8
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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