(2Z)-4-{9,10-dihydroxy-5-methyl-1-oxo-3H,4H-naphtho[2,3-c]pyran-3-yl}-4-(dimethylamino)-3-hydroxybut-2-enamide

Properties Image MNX_ID MNXM1368608 reference metacycM:CPD-19264 formula C20H22N2O6 global charge 0 mol weight 386.404 InChIKey CPENHJHQWNCUHT-JYRVWZFOSA-N InChI InChI=1S/C20H22N2O6/c1-9-10-5-4-6-12(23)16(10)19(26)17-11(9)7-14(28-20(17)27)18(22(2)3)13(24)8-15(21)25/h4-6,8,14,18,23-24,26H,7H2,1-3H3,(H2,21,25)/b13-8- SMILES CC1=C2CC(C(/C(O)=C/C(N)=O)N(C)C)OC(=O)C2=C(O)C2=C1C=CC=C2O MNX internals InChI (mnx) InChI=1/C20H22N2O6/c1-9-10-5-4-6-12(23)16(10)19(26)17-11(9)7-14(28-20(17)27)18(22(2)3)13(24)8-15(21)25/h4-6,8,14,18,23-24,26H,7H2,1-3H3,(H2,21,25)/b13-8-/t14?,18? SMILES (mnx) [CH3:1][C:9]1=[C:10]2[CH:5]=[CH:4][CH:6]=[C:12]([OH:23])[C:16]2=[C:19]([OH:26])[C:17]2=[C:11]1[CH2:7][CH:14]([CH:18](/[C:13](=[CH:8]/[C:15](=[NH:21])[OH:25])[OH:24])[N:22]([CH3:2])[CH3:3])[O:28][C:20]2=[O:27]

Parent-child relations graph

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