ciliatamide B

Properties Image MNX_ID MNXM103837 reference chebi:65631 formula C24H37N3O3 global charge 0 mol weight 415.578 InChIKey FNPKNWJUFWGJJV-NHCUHLMSSA-N InChI InChI=1S/C24H37N3O3/c1-3-4-5-6-10-16-22(28)27(2)21(18-19-13-8-7-9-14-19)24(30)26-20-15-11-12-17-25-23(20)29/h7-9,13-14,20-21H,3-6,10-12,15-18H2,1-2H3,(H,25,29)(H,26,30)/t20-,21-/m1/s1 SMILES CCCCCCCC(=O)N(C)[C@H](CC1=CC=CC=C1)C(=O)N[C@@H]1CCCCNC1=O MNX internals InChI (mnx) InChI=1/C24H37N3O3/c1-3-4-5-6-10-16-22(28)27(2)21(18-19-13-8-7-9-14-19)24(30)26-20-15-11-12-17-25-23(20)29/h7-9,13-14,20-21H,3-6,10-12,15-18H2,1-2H3,(H,25,29)(H,26,30)/t20-,21-/m1/s1 SMILES (mnx) [CH3:1][CH2:3][CH2:4][CH2:5][CH2:6][CH2:10][CH2:16][C:22]([N:27]([CH3:2])[C@H:21]([CH2:18][C:19]1=[CH:13][CH:8]=[CH:7][CH:9]=[CH:14]1)[C:24](=[N:26][C@@H:20]1[CH2:15][CH2:11][CH2:12][CH2:17][N:25]=[C:23]1[OH:29])[OH:30])=[O:28]

Parent-child relations graph

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