Glycoside
GD107402
Name:
3,5-dihydroxy-2-methyl-6-({3,4,5-trihydroxy-6-[(3-phenylprop-2-enoyl)oxy]oxan-2-yl}methoxy)oxan-4-yl 3-phenylprop-2-enoateFormula:
C30H34O12Smiles:
C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC(=O)/C=C/c3ccccc3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](OC(=O)/C=C/c2ccccc2)[C@H]1OAglycone:
O=C(O)C=Cc1ccccc1.O=C(O)C=Cc1ccccc1Sugarmoiety:
CC1OC(OCC2OC(O)C(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.4 |
| AlogP: | 0.16 | Num_rotatable_bonds: | 9 |
| MolWt: | 586.59 | Num_heavy_atoms: | 42 |
| TPSA: | 181.44 | NumAromaticRings: | 2 |
Unique Aglycone
AD00362
Formula: C9H8O2
Smiles:
O=C(O)C=Cc1ccccc1| HBA: | 2 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 1.78 | Num_rotatable_bonds: | 2 |
| MolWt: | 148.16 | Num_heavy_atoms: | 11 |
| TPSA: | 37.3 | NumAromaticRings: | 1 |
