Glycoside
GD000206
Name:
NoneFormula:
C38H48O14Smiles:
O=C(O)Cc1cccc(-c2cc(CCCCCCc3ccc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cc3)ccc2O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c1Aglycone:
O=C(O)Cc1cccc(-c2cc(CCCCCCc3ccc(O)cc3)ccc2O)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 5 |
| HBD: | 9 | FractionCSP3: | 0.5 |
| AlogP: | 0.68 | Num_rotatable_bonds: | 16 |
| MolWt: | 728.79 | Num_heavy_atoms: | 52 |
| TPSA: | 236.06 | NumAromaticRings: | 3 |
Unique Aglycone
AD00241
Formula: C26H28O4
Smiles:
O=C(O)Cc1cccc(-c2cc(CCCCCCc3ccc(O)cc3)ccc2O)c1| HBA: | 4 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.27 |
| AlogP: | 5.74 | Num_rotatable_bonds: | 10 |
| MolWt: | 404.51 | Num_heavy_atoms: | 30 |
| TPSA: | 77.76 | NumAromaticRings: | 3 |
