12-hydroxydihydrochelirubine

Properties Image MNX_ID MNXM2312 reference chebi:15716 formula C21H17NO6 global charge 0 mol weight 379.368 InChIKey LEHAJESKGINQOW-UHFFFAOYSA-N InChI InChI=1S/C21H17NO6/c1-22-7-13-19(17(24-2)6-18-21(13)28-9-27-18)12-3-14(23)10-4-15-16(26-8-25-15)5-11(10)20(12)22/h3-6,23H,7-9H2,1-2H3 SMILES COC1=CC2=C(OCO2)C2=C1C1=C(C3=C(C=C4OCOC4=C3)C(O)=C1)N(C)C2 MNX internals InChI (mnx) InChI=1/C21H17NO6/c1-22-7-13-19(17(24-2)6-18-21(13)28-9-27-18)12-3-14(23)10-4-15-16(26-8-25-15)5-11(10)20(12)22/h3-6,23H,7-9H2,1-2H3 SMILES (mnx) [CH3:1][N:22]1[CH2:7][C:13]2=[C:19]([C:12]3=[CH:3][C:14]([OH:23])=[C:10]4[CH:4]=[C:15]5[C:16](=[CH:5][C:11]4=[C:20]31)[O:26][CH2:8][O:25]5)[C:17]([O:24][CH3:2])=[CH:6][C:18]1=[C:21]2[O:28][CH2:9][O:27]1

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 5 in models (compartimentalized) 0