Coumatetralyl

Properties Image MNX_ID MNXM47749 reference chebi:80742 formula C19H16O3 global charge 0 mol weight 292.334 InChIKey ULSLJYXHZDTLQK-UHFFFAOYSA-N InChI InChI=1S/C19H16O3/c20-18-15-9-3-4-11-16(15)22-19(21)17(18)14-10-5-7-12-6-1-2-8-13(12)14/h1-4,6,8-9,11,14,20H,5,7,10H2 SMILES O=C1OC2=C(C=CC=C2)C(O)=C1C1CCCC2=C1C=CC=C2 MNX internals InChI (mnx) InChI=1/C19H16O3/c20-18-15-9-3-4-11-16(15)22-19(21)17(18)14-10-5-7-12-6-1-2-8-13(12)14/h1-4,6,8-9,11,14,20H,5,7,10H2/t14? SMILES (mnx) [CH:1]1=[CH:2][CH:8]=[C:13]2[C:12](=[CH:6]1)[CH2:7][CH2:5][CH2:10][CH:14]2[C:17]1=[C:18]([OH:20])[C:15]2=[CH:9][CH:3]=[CH:4][CH:11]=[C:16]2[O:22][C:19]1=[O:21]

Parent-child relations graph

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