2-epi-Darunavir
Product Code
TRC-D193530-10MG
CAS Number
Product Format
Neat
Matrix
-
Molecular Formula
C27 H37 N3 O7 S
Molecular Weight
547.66
Product Information
CAS Number
850141-19-4
Molecular Formula
C27 H37 N3 O7 S
Molecular Weight
547.66
Accurate Mass
547.2352
Smiles
CC(C)CN(C[C@H](O)[C@H](Cc1ccccc1)NC(=O)O[C@H]2CO[C@H]3OCC[C@@H]23)S(=O)(=O)c4ccc(N)cc4
InChI
InChI=1S/C27H37N3O7S/c1-18(2)15-30(38(33,34)21-10-8-20(28)9-11-21)16-24(31)23(14-19-6-4-3-5-7-19)29-27(32)37-25-17-36-26-22(25)12-13-35-26/h3-11,18,22-26,31H,12-17,28H2,1-2H3,(H,29,32)/t22-,23-,24-,25-,26+/m0/s1
IUPAC
[(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] N-[(2S,3S)-4-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino]-3-hydroxy-1-phenylbutan-2-yl]carbamate
Country of Origin
CANADA
Product Format
Neat
Matrix
-