Glycoside
GD148608
Name:
malvidin 3-rhamnosideFormula:
C23H27O11Smiles:
COc1cc(C2Oc3cc([OH2+])cc(O)c3C=C2OC2OC(C)C(O)C(O)C2O)cc(OC)c1OAglycone:
COc1cc(C2Oc3cc([OH2+])cc(O)c3C=C2O)cc(OC)c1OSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.39 |
| AlogP: | 0.87 | Num_rotatable_bonds: | 5 |
| MolWt: | 479.46 | Num_heavy_atoms: | 34 |
| TPSA: | 170.2 | NumAromaticRings: | 2 |
Unique Aglycone
AD46609
Formula: C17H17O7
Smiles:
COc1cc(C2Oc3cc([OH2+])cc(O)c3C=C2O)cc(OC)c1O| HBA: | 7 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.18 |
| AlogP: | 2.59 | Num_rotatable_bonds: | 3 |
| MolWt: | 333.32 | Num_heavy_atoms: | 24 |
| TPSA: | 111.28 | NumAromaticRings: | 2 |
