stipitalide

Properties Image MNX_ID MNXM165165 reference metacycM:CPD-18151 formula C9H5O5 global charge -1 mol weight 193.134 InChIKey FZWZZYUAWYMFBS-UHFFFAOYSA-M InChI InChI=1S/C9H6O5/c10-5-1-4-3-14-9(13)8(4)7(12)2-6(5)11/h1-2,12H,3H2,(H,10,11)/p-1 SMILES O=C1C=C([O-])C2=C(C=C1O)COC2=O MNX internals InChI (mnx) InChI=1/C9H6O5/c10-5-1-4-3-14-9(13)8(4)7(12)2-6(5)11/h1-2,12H,3H2,(H,10,11) SMILES (mnx) [CH:1]1=[C:4]2[CH2:3][O:14][C:9](=[O:13])[C:8]2=[C:7]([OH:12])[CH:2]=[C:6]([OH:11])[C:5]1=[O:10]

Parent-child relations graph

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