salinosporamide A

Properties Image MNX_ID MNXM21684 reference chebi:48045 formula C15H20ClNO4 global charge 0 mol weight 313.781 InChIKey NGWSFRIPKNWYAO-SHTIJGAHSA-N InChI InChI=1S/C15H20ClNO4/c1-14-10(7-8-16)12(19)17-15(14,13(20)21-14)11(18)9-5-3-2-4-6-9/h3,5,9-11,18H,2,4,6-8H2,1H3,(H,17,19)/t9-,10+,11+,14+,15+/m1/s1 SMILES C[C@@]12OC(=O)[C@]1([C@@H](O)[C@@H]1C=CCCC1)NC(=O)[C@@H]2CCCl MNX internals InChI (mnx) InChI=1/C15H20ClNO4/c1-14-10(7-8-16)12(19)17-15(14,13(20)21-14)11(18)9-5-3-2-4-6-9/h3,5,9-11,18H,2,4,6-8H2,1H3,(H,17,19)/t9-,10+,11+,14+,15+/m1/s1 SMILES (mnx) [CH3:1][C@:14]12[C@@H:10]([CH2:7][CH2:8][Cl:16])[C:12]([OH:19])=[N:17][C@@:15]1([C@H:11]([C@@H:9]1[CH:5]=[CH:3][CH2:2][CH2:4][CH2:6]1)[OH:18])[C:13](=[O:20])[O:21]2

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 2 in models (compartimentalized) 0