Molecular Mechanism of Traditional Chinese Ointment of Xuzhou Qufu Shengji in Infected Wounds

Table 2

Molecular structure of active ingredients of AM and GR in QFSJO decoction (SMILES format) [12, 13].

2′,3′-Dihydroxy-7,4′-dimethoxyisoflavone	Root	O = C1 = C(C2 = CC = C(OC)C = C2)C = OC3 = C(O)C(O) = CC = C31
3′-Hydroxyformononetin	Root	COC1 = C(C = C(C = C1)C2 = COC3 = C(C2 = O)C = CC(=C3)O)O
3-O-β-Dxylopyranosyl-25-o-β-D-glucopyranosyl-cycloastragenol	Plant	C1C(OC2 = C(C(=CC(=C2C1 = O)O)O)C3C(C(C(C(O3)CO)O)O)O)C4 = CC(=C(C = C4)O)O
7,3′-Dihydroxy-9,10-dimethoxypterocarpane	Root	COC1 = C(C2 = C(C = C1)C3COC4 = C(C3O2)C = CC(=C4)O)OC
Astragaloside-I (calis I. et al., 1997)	Root	CC(=O)OC1C(COC(C1OC(=O)C)OC2CCC34CC35CCC6(C(C(CC6(C5CC(C4C2(C)C)OC7C(C(C(C(O7)CO)O)O)O)C)O)C8(CCC(O8)C(C) (C)O)C)C)O
Astragaloside-II^1	Root	CC(=O)OC1C(COC(C1OC(=O)C)OC2CCC34CC35CCC6(C(C(CC6(C5CC(C4C2(C)C)OC7C(C(C(C(O7)CO)O)O)O)C)O)C8(CCC(O8)C(C) (C)O)C)C)O
Astragaloside-III	Root	CC1(C(CCC23C1C(CC4C2(C3)CCC5(C4(CC(C5C6(CCC(O6)C(C) (C)O)C)O)C)C)O)OC7C(C(C(CO7)O)O)OC8C(C(C(C(O8)CO)O)O)O)C
Astragaloside-IV^2	Root	CC1(C(CCC23C1C(CC4C2(C3)CCC5(C4(CC(C5C6(CCC(O6)C(C) (C)O)C)O)C)C)OC7C(C(C(C(O7)CO)O)O)O)OC8C(C(C(CO8)O)O)O)C
Astragaloside-V	Root	CC1(C(CCC23C1C(CC4C2(C3)CCC5(C4(CC(C5C6(CCC(O6)C(C) (C)OC7C(C(C(C(O7)CO)O)O)O)C)O)C)C)O)OC8C(C(C(CO8)O)O)OC9C(C(C(C(O9)CO)O)O)O)C
Astragaloside-VI	Root	CC1(C(CCC23C1C(CC4C2(C3)CCC5(C4(CC(C5C6(CCC(O6)C(C) (C)O)C)O)C)C)OC7C(C(C(C(O7)CO)O)O)O)OC8C(C(C(CO8)O)O)OC9C(C(C(C(O9)CO)O)O)O)C
Astragaloside-VII	Root	CC1(C(CCC23C1C(CC4C2(C3)CCC5(C4(CC(C5C6(CCC(O6)C(C) (C)OC7C(C(C(C(O7)CO)O)O)O)C)O)C)C)OC8C(C(C(C(O8)CO)O)O)O)OC9C(C(C(CO9)O)O)O)C
Astraisoflavone	Root	CC(=CCC1 = C2C(=C(C3 = C1OC = C(C3 = O)C4 = CC(=C(C = C4)O)O)O)C = CC(O2)(C)C)C