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Chemical structure of Selepressin

GC74776

Selepressin

Also known as (2S)-1-[(4R,7S,10S,13S,16S,19R)-19-amino-10-(4-amino-4-oxobutyl)-7-(2-amino-2-oxoethyl)-16-benzyl-13-[(2S)-butan-2-yl]-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carbonyl]-N-[(2S)-1-[(2-amino-2-oxoethyl)amino]-1-oxo-5-(propan-2-ylamino)pentan-2-yl]pyrrolidine-2-carboxamide

Selepressin (FE 202158) is a selective vasopressin V1A receptor agonist

ChemicalCAS876296-47-8MW1048.28FormulaC46H73N13O11S2
CAS number
876296-47-8
Molecular weight
1048.28
Formula
C46H73N13O11S2
Solubility
DMSO： ≥ 100 mg/mL (95·39 mM)
InChIKey
JCVQBJTWWDYUFQ-MRUTUVJXSA-N
Catalogue number
GC74776
Brand
GLPBIO
Computed properties PubChem CID 53330936 · XLogP -2.5 · TPSA 442 Ų · H-bond donors 12
XLogP
-2.5
TPSA
442 Ų
H-bond donors
12
H-bond acceptors
15
Rotatable bonds
21
Heavy atoms
72

SMILES CC[C@H](C)[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CSSC[C@@H](C(=O)N[C@H](C(=O)N1)CC2=CC=CC=C2)N)C(=O)N3CCC[C@H]3C(=O)N[C@@H](CCCNC(C)C)C(=O)NCC(=O)N)CC(=O)N)CCCC(=O)N

Computed descriptors from PubChem (CID 53330936), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

Lead time
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Pricing
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Documents
Lot certificate of analysis and manufacturer SDS are emailed with your order confirmation.
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