(2S,3R)-3-hydroxy-2-isopropyl-4-methoxy-4-oxobutanoate

Properties Image MNX_ID MNXM1132970 reference metacycM:CPD3O-4155 formula C8H13O5 global charge -1 mol weight 189.187 InChIKey YFUPBIBIDVFELV-NTSWFWBYSA-M InChI InChI=1S/C8H14O5/c1-4(2)5(7(10)11)6(9)8(12)13-3/h4-6,9H,1-3H3,(H,10,11)/p-1/t5-,6+/m0/s1 SMILES COC(=O)[C@H](O)[C@@H](C(=O)[O-])C(C)C MNX internals InChI (mnx) InChI=1/C8H14O5/c1-4(2)5(7(10)11)6(9)8(12)13-3/h4-6,9H,1-3H3,(H,10,11)/t5-,6+/m0/s1 SMILES (mnx) [CH3:1][CH:4]([CH3:2])[C@@H:5]([C@H:6]([C:8](=[O:12])[O:13][CH3:3])[OH:9])[C:7](=[O:10])[OH:11]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 1 in models (compartimentalized) 0