Glycoside
GD123241
Name:
4',7-dihydroxyisoflavone; 4'-o-[α-l-rhamnopyranosyl-(1->6)-β-d-glucopyranoside]Formula:
C27H30O13Smiles:
CC1OC(OCC2OC(Oc3ccc(-c4coc5cc(O)ccc5c4=O)cc3)C(O)C(O)C2O)C(O)C(O)C1OAglycone:
O=c1c(-c2ccc(O)cc2)coc2cc(O)ccc12Sugarmoiety:
CC1OC(OCC2OC(O)C(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 5 |
| HBD: | 7 | FractionCSP3: | 0.44 |
| AlogP: | -0.8 | Num_rotatable_bonds: | 6 |
| MolWt: | 562.52 | Num_heavy_atoms: | 40 |
| TPSA: | 208.74 | NumAromaticRings: | 3 |
Unique Aglycone
AD04556
Formula: C15H10O4
Smiles:
O=c1c(-c2ccc(O)cc2)coc2cc(O)ccc12| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 2.87 | Num_rotatable_bonds: | 1 |
| MolWt: | 254.24 | Num_heavy_atoms: | 19 |
| TPSA: | 70.67 | NumAromaticRings: | 3 |
