dehydrorabelomycin

Properties Image MNX_ID MNXM5118 reference chebi:31461 formula C19H12O5 global charge 0 mol weight 320.3 InChIKey PQVIKROZFPIERS-UHFFFAOYSA-N InChI InChI=1S/C19H12O5/c1-8-5-9-7-13(22)16-17(14(9)12(21)6-8)18(23)10-3-2-4-11(20)15(10)19(16)24/h2-7,20-22H,1H3 SMILES CC1=CC2=CC(O)=C3C(=O)C4=C(C=CC=C4O)C(=O)C3=C2C(O)=C1 MNX internals InChI (mnx) InChI=1/C19H12O5/c1-8-5-9-7-13(22)16-17(14(9)12(21)6-8)18(23)10-3-2-4-11(20)15(10)19(16)24/h2-7,20-22H,1H3 SMILES (mnx) [CH3:1][C:8]1=[CH:5][C:9]2=[CH:7][C:13]([OH:22])=[C:16]3[C:17](=[C:14]2[C:12]([OH:21])=[CH:6]1)[C:18](=[O:23])[C:10]1=[C:15]([C:11]([OH:20])=[CH:4][CH:2]=[CH:3]1)[C:19]3=[O:24]

Parent-child relations graph

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