Glycoside

GD028897
Name:
NoneFormula:
C42H68O16Smiles:
CC(=O)[C@@H]1CC[C@]2(C)[C@H]1C(=O)C[C@@H]1[C@]3(C)CC[C@H](O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O[C@@H]5O[C@H](C)[C@H](O)[C@H](O)[C@H]5O)[C@H]4O[C@@H]4O[C@H](C)[C@H](O)[C@H](O)[C@H]4O)C(C)(C)[C@H]3CC[C@]12CAglycone:
CC(=O)C1CCC2(C)C1C(=O)CC1C3(C)CCC(O)C(C)(C)C3CCC12CSugarmoiety:
CC1OC(OC2C(O)OC(CO)C(O)C2OC2OC(C)C(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 16 | RingCount: | 7 |
HBD: | 8 | FractionCSP3: | 0.95 |
AlogP: | 0.33 | Num_rotatable_bonds: | 8 |
MolWt: | 828.99 | Num_heavy_atoms: | 58 |
TPSA: | 251.36 | NumAromaticRings: | 0 |
Unique Aglycone
AD18837
Formula: C24H38O3
Smiles:
CC(=O)C1CCC2(C)C1C(=O)CC1C3(C)CCC(O)C(C)(C)C3CCC12CHBA: | 3 | RingCount: | 4 |
HBD: | 1 | FractionCSP3: | 0.92 |
AlogP: | 4.8 | Num_rotatable_bonds: | 1 |
MolWt: | 374.57 | Num_heavy_atoms: | 27 |
TPSA: | 54.37 | NumAromaticRings: | 0 |