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Product Code
TRC-N565115
CAS Number
Product Format
Neat
Molecular Formula
C23 H31 N7 O7 S
Molecular Weight
549.60
Product Categories
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Analyte Name
N-Nitro-1,2,3,4-tetradehydroargatroban
CAS Number
74874-10-5
Molecular Formula
C23 H31 N7 O7 S
Molecular Weight
549.60
Accurate Mass
549.2006
SMILES
C[C@@H]1CCN([C@H](C1)C(=O)O)C(=O)[C@H](CCCNC(=N)N[N+](=O)[O-])NS(=O)(=O)c2cccc3cc(C)cnc23
InChI
InChI=1S/C23H31N7O7S/c1-14-8-10-29(18(12-14)22(32)33)21(31)17(6-4-9-25-23(24)27-30(34)35)28-38(36,37)19-7-3-5-16-11-15(2)13-26-20(16)19/h3,5,7,11,13-14,17-18,28H,4,6,8-10,12H2,1-2H3,(H,32,33)(H3,24,25,27)/t14-,17+,18-/m1/s1
IUPAC
(2R,4R)-4-methyl-1-[(2S)-2-[(3-methylquinolin-8-yl)sulfonylamino]-5-[(N-nitrocarbamimidoyl)amino]pentanoyl]piperidine-2-carboxylic acid
Storage Temperature
-20°C
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Format
Neat
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