BGC > Product Search > Firategrast

Molecular Formula: C27H27F2NO6
Molecular Weight: 499.5031864

Molecular Formula: C27H27F2NO6
Molecular Weight: 499.5031864

Description :
Firategrast is an orally bioavailable alpha4 beta1/alpha4 beta7 integrin antagonist designed to reduce trafficking of lymphocytes into the central nervous system (CNS).

• Molecular Weight :499.5
• Purity :> 98%

Molecular Formula :
C27H27F2NO6
Canonical SMILES :
CCOCC1=CC(=C(C(=C1)OC)C2=CC=C(C=C2)CC(C(=O)O)NC(=O)C3=C(C=CC=C3F)F)OC
InChI :
InChI=1S/C27H27F2NO6/c1-4-36-15-17-13-22(34-2)24(23(14-17)35-3)18-10-8-16(9-11-18)12-21(27(32)33)30-26(31)25-19(28)6-5-7-20(25)29/h5-11,13-14,21H,4,12,15H2,1-3H3,(H,30,31)(H,32,33)/t21-/m0/s1
InChIKey :
YLFZHHDVRSYTKT-NRFANRHFSA-N
Synonyms :
SB-683699; SB 683699; SB683699; T-0047; T 0047; T0047; Firategrast

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