(R)-littorine

Properties Image MNX_ID MNXM5812 reference chebi:234341 formula C17H24NO3 global charge 1 mol weight 290.383 InChIKey FNRXUEYLFZLOEZ-FXUDXRNXSA-O InChI InChI=1S/C17H23NO3/c1-18-13-7-8-14(18)11-15(10-13)21-17(20)16(19)9-12-5-3-2-4-6-12/h2-6,13-16,19H,7-11H2,1H3/p+1/t13-,14+,15+,16-/m1/s1 SMILES C[NH+]1[C@@H]2CC[C@H]1C[C@@H](OC(=O)[C@H](O)CC1=CC=CC=C1)C2 MNX internals InChI (mnx) InChI=1/C17H23NO3/c1-18-13-7-8-14(18)11-15(10-13)21-17(20)16(19)9-12-5-3-2-4-6-12/h2-6,13-16,19H,7-11H2,1H3/t13-,14+,15+,16-/m1/s1 SMILES (mnx) [CH3:1][N:18]1[C@@H:13]2[CH2:7][CH2:8][C@H:14]1[CH2:11][C@@H:15]([O:21][C:17]([C@@H:16]([CH2:9][C:12]1=[CH:5][CH:3]=[CH:2][CH:4]=[CH:6]1)[OH:19])=[O:20])[CH2:10]2

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 7 in models (compartimentalized) 0