Etrasimod

Orukọ Kemikali:

(R) -2- (7- ((4-cyclopentyl-3- (trifluoromethyl) benzyl) oxy) -1,2,3,4-tetrahydrocyclopenta [b] indol-3-yl) acetic acid

KỌỌDỌ SMILES:

O=C(O)C[C@H]1CCC2=C1NC3=C2C=C(OCC4=CC=C(C5CCCC5)C(C(F)(F)F)=C4)C=C3

Koodu InChi:

InChi=1S/C26H26F3NO3/c27-26(28,29)22-11-15(5-8-19(22)16-3-1-2-4-16)14-33-18-7-10- 23-21 (13-18) 20-9-6-17 (12-24 (31)32)25 (20) 30-23 / h5,7-8,10-11,13,16-17,30H, 1-4,6,9,12,14H2,(H,31,32)/t17-/m1/s1

Bọtini InChi:

MVGWUTBTXDYMND-QGZVFWFLSA-N

Koko:

APD334 1206123-37-6 (ipilẹ ọfẹ) 1206123-97-8 (arginine)

Solubility: 

Ibi ipamọ: 

Apejuwe:

Àfojúsùn: S1P1