Mol:Bisdemethoxycurcumin
From Metabolomics.JP
ACD/Labs11090715362D 23 24 0 0 0 0 0 0 0 0 1 V2000 16.9196 -12.5709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9196 -13.9009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7676 -11.9059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7676 -14.5659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6159 -12.5709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6159 -13.9009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0714 -11.9059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2232 -12.5709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.3750 -11.9059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.5268 -12.5709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.6786 -11.9058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.8304 -12.5708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.9822 -11.9058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.1341 -12.5708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.4377 -12.5708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.4377 -13.9008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.2858 -11.9058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.2858 -14.5658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.1341 -13.9008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4640 -14.5659 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.3750 -10.5759 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.6786 -10.5758 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 29.5895 -14.5659 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 3 1 2 0 0 0 0 4 2 2 0 0 0 0 5 3 1 0 0 0 0 6 4 1 0 0 0 0 6 5 2 0 0 0 0 1 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 16 15 1 0 0 0 0 17 15 2 0 0 0 0 18 16 2 0 0 0 0 14 17 1 0 0 0 0 19 18 1 0 0 0 0 19 14 2 0 0 0 0 6 20 1 0 0 0 0 9 21 2 0 0 0 0 11 22 2 0 0 0 0 16 23 1 0 0 0 0 S SKP 5 ID Bisdemethoxycurcumin FORMULA C19H16O4 EXACTMASS 308.104859 AVERAGEMASS 308.32794 SMILES Oc(c1)ccc(C=CC(=O)CC(=O)C=Cc(c2)ccc(O)c2)c1 M END