Glycoside
GD002679
Name:
MAYOSIDE DFormula:
C28H26O9Smiles:
Cc1cc(O)c2c(c1)[C@](O)(C[C@@H]1OC[C@H](OC(=O)c3ccccc3)[C@H](O)[C@H]1O)c1cccc(O)c1C2=OAglycone:
Cc1cc(O)c2c(c1)C(C)(O)c1cccc(O)c1C2=O.O=C(O)c1ccccc1Sugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.29 |
| AlogP: | 1.92 | Num_rotatable_bonds: | 4 |
| MolWt: | 506.51 | Num_heavy_atoms: | 37 |
| TPSA: | 153.75 | NumAromaticRings: | 3 |
Unique Aglycone
AD00002
Formula: C7H6O2
Smiles:
O=C(O)c1ccccc1| HBA: | 2 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 1.38 | Num_rotatable_bonds: | 1 |
| MolWt: | 122.12 | Num_heavy_atoms: | 9 |
| TPSA: | 37.3 | NumAromaticRings: | 1 |
AD02527
Formula: C16H14O4
Smiles:
Cc1cc(O)c2c(c1)C(C)(O)c1cccc(O)c1C2=O| HBA: | 4 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.19 |
| AlogP: | 2.21 | Num_rotatable_bonds: | 0 |
| MolWt: | 270.28 | Num_heavy_atoms: | 20 |
| TPSA: | 77.76 | NumAromaticRings: | 2 |
