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Chemical structure of Rotigaptide

GC39432

Rotigaptide

Also known as (2R,4S)-1-[(2R)-1-[(2R)-2-acetamido-3-(4-hydroxyphenyl)propanoyl]pyrrolidine-2-carbonyl]-N-[2-[[(2R)-1-[(2-amino-2-oxoethyl)amino]-1-oxopropan-2-yl]amino]-2-oxoethyl]-4-hydroxypyrrolidine-2-carboxamide

Rotigaptide (ZP123) is a novel and specific modulator of connexin 43 (Cx43)

ChemicalCAS355151-12-1MW617.65FormulaC28H39N7O9
CAS number
355151-12-1
Molecular weight
617.65
Formula
C28H39N7O9
Solubility
DMSO ： 100 mg/mL (161·90 mM; Need ultrasonic)
InChIKey
GFJRASPBQLDRRY-TWTQBQJDSA-N
Catalogue number
GC39432
Brand
GLPBIO
Computed properties PubChem CID 9938933 · XLogP -2.3 · TPSA 241 Ų · H-bond donors 7
XLogP
-2.3
TPSA
241 Ų
H-bond donors
7
H-bond acceptors
9
Rotatable bonds
12
Heavy atoms
44

SMILES C[C@H](C(=O)NCC(=O)N)NC(=O)CNC(=O)[C@H]1C[C@@H](CN1C(=O)[C@H]2CCCN2C(=O)[C@@H](CC3=CC=C(C=C3)O)NC(=O)C)O

Computed descriptors from PubChem (CID 9938933), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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