Search MNXref
 Feedback

(8R,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-9-[[methyl-[[2-(trifluoromethyl)phenyl]methyl]amino]methyl]-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-5-one

PropertiesImage
MNX_IDMNXM173485 Image of MNXM173485
referencechebi:96531
formulaC24H34F3N5O3
global charge0
mol weight497.562
InChIKeyQZCZRKJJOTUXQW-HMFYCAOWSA-N
InChIInChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)9-6-10-32-20(11-28-29-32)16-35-22(17)14-30(3)13-19-7-4-5-8-21(19)24(25,26)27/h4-5,7-8,11,17-18,22,33H,6,9-10,12-16H2,1-3H3/t17-,18-,22+/m1/s1
SMILESC[C@@H]1CN([C@H](C)CO)C(=O)CCCN2N=NC=C2CO[C@H]1CN(C)CC1=CC=CC=C1C(F)(F)F
MNX internals
InChI (mnx)InChI=1/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)9-6-10-32-20(11-28-29-32)16-35-22(17)14-30(3)13-19-7-4-5-8-21(19)24(25,26)27/h4-5,7-8,11,17-18,22,33H,6,9-10,12-16H2,1-3H3/t17-,18-,22+/m1/s1 Image of MNXM173485
SMILES (mnx)[CH3:1][C@@H:17]1[CH2:12][N:31]([C@H:18]([CH3:2])[CH2:15][OH:33])[C:23](=[O:34])[CH2:9][CH2:6][CH2:10][N:32]2[C:20](=[CH:11][N:28]=[N:29]2)[CH2:16][O:35][C@H:22]1[CH2:14][N:30]([CH3:3])[CH2:13][C:19]1=[CH:7][CH:4]=[CH:5][CH:8]=[C:21]1[C:24]([F:25])([F:26])[F:27]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:96531
chebi:96531
QZCZRKJJOTUXQW-HMFYCAOWSA-N
(8R,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-9-[[methyl-[[2-(trifluoromethyl)phenyl]methyl]amino]methyl]-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-5-one