(8S,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-9-[[methyl(pyridin-4-ylmethyl)amino]methyl]-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-5-one

Properties Image MNX_ID MNXM173715 reference chebi:96014 formula C22H34N6O3 global charge 0 mol weight 430.553 InChIKey NJZPXWDDBMYIMJ-UEXGIBASSA-N InChI InChI=1S/C22H34N6O3/c1-17-12-27(18(2)15-29)22(30)5-4-10-28-20(11-24-25-28)16-31-21(17)14-26(3)13-19-6-8-23-9-7-19/h6-9,11,17-18,21,29H,4-5,10,12-16H2,1-3H3/t17-,18+,21-/m0/s1 SMILES C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2=CC=NC=C2)OCC2=CN=NN2CCCC1=O MNX internals InChI (mnx) InChI=1/C22H34N6O3/c1-17-12-27(18(2)15-29)22(30)5-4-10-28-20(11-24-25-28)16-31-21(17)14-26(3)13-19-6-8-23-9-7-19/h6-9,11,17-18,21,29H,4-5,10,12-16H2,1-3H3/t17-,18+,21-/m0/s1 SMILES (mnx) [CH3:1][C@H:17]1[CH2:12][N:27]([C@H:18]([CH3:2])[CH2:15][OH:29])[C:22](=[O:30])[CH2:5][CH2:4][CH2:10][N:28]2[C:20](=[CH:11][N:24]=[N:25]2)[CH2:16][O:31][C@H:21]1[CH2:14][N:26]([CH3:3])[CH2:13][C:19]1=[CH:7][CH:9]=[N:23][CH:8]=[CH:6]1

Parent-child relations graph

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