Glycoside
GD132134
Name:
7-hydroxy-3,5-bis({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy})-2H-chromen-2-oneFormula:
C21H26O15Smiles:
O=c1oc2cc(O)cc(OC3OC(CO)C(O)C(O)C3O)c2cc1OC1OC(CO)C(O)C(O)C1OAglycone:
O=c1oc2cc(O)cc(O)c2cc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 4 |
| HBD: | 9 | FractionCSP3: | 0.57 |
| AlogP: | -4.14 | Num_rotatable_bonds: | 6 |
| MolWt: | 518.42 | Num_heavy_atoms: | 36 |
| TPSA: | 249.2 | NumAromaticRings: | 2 |
Unique Aglycone
AD53494
Formula: C9H6O5
Smiles:
O=c1oc2cc(O)cc(O)c2cc1O| HBA: | 5 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 0.91 | Num_rotatable_bonds: | 0 |
| MolWt: | 194.14 | Num_heavy_atoms: | 14 |
| TPSA: | 90.9 | NumAromaticRings: | 2 |
