1-[2-[(2S,5S,6R)-6-(hydroxymethyl)-5-[(4-phenoxyphenyl)sulfonylamino]-2-oxanyl]ethyl]-3-propan-2-ylurea

Properties Image MNX_ID MNXM340862 reference chebi:102646 formula C24H33N3O6S global charge 0 mol weight 491.61 InChIKey URVFCIGKBRHLNA-PMVMPFDFSA-N InChI InChI=1S/C24H33N3O6S/c1-17(2)26-24(29)25-15-14-20-10-13-22(23(16-28)33-20)27-34(30,31)21-11-8-19(9-12-21)32-18-6-4-3-5-7-18/h3-9,11-12,17,20,22-23,27-28H,10,13-16H2,1-2H3,(H2,25,26,29)/t20-,22-,23-/m0/s1 SMILES CC(C)NC(=O)NCC[C@@H]1CC[C@H](NS(=O)(=O)C2=CC=C(OC3=CC=CC=C3)C=C2)[C@H](CO)O1 MNX internals InChI (mnx) InChI=1/C24H33N3O6S/c1-17(2)26-24(29)25-15-14-20-10-13-22(23(16-28)33-20)27-34(30,31)21-11-8-19(9-12-21)32-18-6-4-3-5-7-18/h3-9,11-12,17,20,22-23,27-28H,10,13-16H2,1-2H3,(H2,25,26,29)/t20-,22-,23-/m0/s1 SMILES (mnx) [CH3:1][CH:17]([CH3:2])[NH:26][C:24](=[N:25][CH2:15][CH2:14][C@@H:20]1[CH2:10][CH2:13][C@H:22]([NH:27][S:34]([C:21]2=[CH:12][CH:9]=[C:19]([O:32][C:18]3=[CH:6][CH:4]=[CH:3][CH:5]=[CH:7]3)[CH:8]=[CH:11]2)(=[O:30])=[O:31])[C@H:23]([CH2:16][OH:28])[O:33]1)[OH:29]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0