Glycoside

GD009514
Name:
NoneFormula:
C48H80O18Smiles:
CO[C@H]1C[C@@H](O[C@@H]2[C@@H](C)O[C@@H](O[C@@H]3[C@H](C)O[C@H](O[C@@H]4[C@H](C)O[C@H](O[C@@H]5CC[C@]6(C)[C@H](CC[C@@H]7[C@H]6CC[C@]6(C)[C@H](C(C)=O)[C@H](O)[C@H](O)[C@]76O)C5)[C@H](O)[C@H]4OC)C[C@H]3O)C[C@H]2OC)O[C@@H](C)[C@H]1OAglycone:
CC(=O)C1C(O)C(O)C2(O)C3CCC4CC(O)CCC4(C)C3CCC12CSugarmoiety:
COC1CC(OC2C(C)OC(OC3C(O)CC(OC4C(C)OC(O)C(O)C4OC)OC3C)CC2OC)OC(C)C1OOther Identifiers
Properties
HBA: | 18 | RingCount: | 8 |
HBD: | 6 | FractionCSP3: | 0.98 |
AlogP: | 2.11 | Num_rotatable_bonds: | 12 |
MolWt: | 945.15 | Num_heavy_atoms: | 66 |
TPSA: | 239.98 | NumAromaticRings: | 0 |
Unique Aglycone
AD03430
Formula: C21H34O5
Smiles:
CC(=O)C1C(O)C(O)C2(O)C3CCC4CC(O)CCC4(C)C3CCC12CHBA: | 5 | RingCount: | 4 |
HBD: | 4 | FractionCSP3: | 0.95 |
AlogP: | 1.65 | Num_rotatable_bonds: | 1 |
MolWt: | 366.5 | Num_heavy_atoms: | 26 |
TPSA: | 97.99 | NumAromaticRings: | 0 |