Glycoside
GD122642
Name:
Caucasicoside AFormula:
C33H50O10Smiles:
C=C(CCC1=C(C)C2C(CC3C4CC=C5CC(O)CC(O)C5(C)C4C(O)CC32C)O1)COC1OC(CO)C(O)C(O)C1OAglycone:
C=C(CO)CCC1=C(C)C2C(CC3C4CC=C5CC(O)CC(O)C5(C)C4C(O)CC32C)O1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 6 |
| HBD: | 7 | FractionCSP3: | 0.82 |
| AlogP: | 1.3 | Num_rotatable_bonds: | 7 |
| MolWt: | 606.75 | Num_heavy_atoms: | 43 |
| TPSA: | 169.3 | NumAromaticRings: | 0 |
Unique Aglycone
AD49438
Formula: C27H40O5
Smiles:
C=C(CO)CCC1=C(C)C2C(CC3C4CC=C5CC(O)CC(O)C5(C)C4C(O)CC32C)O1| HBA: | 5 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.78 |
| AlogP: | 3.48 | Num_rotatable_bonds: | 4 |
| MolWt: | 444.61 | Num_heavy_atoms: | 32 |
| TPSA: | 90.15 | NumAromaticRings: | 0 |
