Glycoside
GD117351
Name:
3-o-{beta-d-galactopyranosyl-(1-2)-[beta-d-glucopyranosyl-(1-6)-]-beta-d-+Formula:
C37H60O16Smiles:
CC12CCCC1C1=C(CC2)C2(C)CCC(OC3OC(COC4OC(CO)C(O)C(O)C4O)C(O)C(OC4OC(CO)C(O)C(O)C4O)C3O)CC2CC1Aglycone:
CC12CCCC1C1=C(CC2)C2(C)CCC(O)CC2CC1Sugarmoiety:
OCC1OC(OCC2OC(O)C(O)C(OC3OC(CO)C(O)C(O)C3O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 16 | RingCount: | 7 |
| HBD: | 10 | FractionCSP3: | 0.95 |
| AlogP: | -1.68 | Num_rotatable_bonds: | 9 |
| MolWt: | 760.87 | Num_heavy_atoms: | 53 |
| TPSA: | 257.68 | NumAromaticRings: | 0 |
Unique Aglycone
AD02863
Formula: C19H30O
Smiles:
CC12CCCC1C1=C(CC2)C2(C)CCC(O)CC2CC1| HBA: | 1 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.89 |
| AlogP: | 4.84 | Num_rotatable_bonds: | 0 |
| MolWt: | 274.45 | Num_heavy_atoms: | 20 |
| TPSA: | 20.23 | NumAromaticRings: | 0 |
