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Chemical structure of Neuronostatin-13 human

GC31162

Neuronostatin-13 human

Also known as (2S)-N-[(2R)-1-[[(2S)-1-[[(2S)-5-amino-1-[[(2S)-6-amino-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-amino-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-1-oxohexan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]-2-[[(2S)-2-[[(2S)-2-amino-4-methylpentanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]pentanediamide

Neuronostatin-13 human is a 13-amino acid peptide hormone encoded by the somatostatin gene and plays an important role in the regulation of hormonal and cardiac function

ChemicalCAS1096485-24-3MW1415.68FormulaC64H110N20O16
CAS number
1096485-24-3
Molecular weight
1415.68
Formula
C64H110N20O16
Solubility
H2O : 25 mg/mL (17·66 mM; Need ultrasonic)
InChIKey
FOBROQPAHZFJIA-QACLBKBCSA-N
Catalogue number
GC31162
Brand
GLPBIO
Computed properties PubChem CID 138106610 · XLogP -3.7 · TPSA 615 Ų · H-bond donors 20
XLogP
-3.7
TPSA
615 Ų
H-bond donors
20
H-bond acceptors
19
Rotatable bonds
48
Heavy atoms
100

SMILES C[C@@H](C(=O)N)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)N

Computed descriptors from PubChem (CID 138106610), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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