CAS 5534-95-2 Pentagastrin - Analytical Products / Alfa Chemistry

CAT	APS5534952
CAS	5534-95-2
Structure
MDL Number	MFCD00076515
Synonyms	Pentagastrin
IUPAC Name	(3S)-4-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]-3-[[(2S)-2-[[(2S)-3-(1H-indol-3-yl)-2-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoylamino]propanoyl]amino]-4-methylsulfanylbutanoyl]amino]-4-oxobutanoic acid
Molecular Weight	767.89
Molecular Formula	C37H49N7O9S
EC Number	226-889-7
Canonical SMILES	CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCNC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc3ccccc3)C(=O)N
InChI	InChI=1S/C37H49N7O9S/c1-37(2,3)53-36(52)39-16-14-30(45)41-28(19-23-21-40-25-13-9-8-12-24(23)25)34(50)42-26(15-17-54-4)33(49)44-29(20-31(46)47)35(51)43-27(32(38)48)18-22-10-6-5-7-11-22/h5-13,21,26-29,40H,14-20H2,1-4H3,(H2,38,48)(H,39,52)(H,41,45)(H,42,50)(H,43,51)(H,44,49)(H,46,47)/t26-,27-,28-,29-/m0/s1
InChI Key	NEYNJQRKHLUJRU-UHFFFAOYSA-N

Description	≥95% (HPLC), powder
Accurate Mass	767.3312
API Family	Matrix - API Family See respective official monograph(s)
Assay	≥95% (HPLC)
Form	powder
Format	Neat
Product Type	API
Shipping	Ice pack (-20°C)
Size	25MG, 100MG
Storage Conditions	Freezer
Subcategory	British Pharmacopoeia