Glycoside

GD006918
Name:
NoneFormula:
C42H70O12Smiles:
C=C(C)[C@@H]1CC[C@]2(CO[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)[C@H](CC[C@@H]4[C@]5(C)CC[C@H](O[C@@H]6O[C@H](CO)[C@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@H]5CC[C@]43C)[C@H]12Aglycone:
C=C(C)C1CCC2(CO)CCC3(C)C(CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 12 | RingCount: | 7 |
HBD: | 8 | FractionCSP3: | 0.95 |
AlogP: | 2.65 | Num_rotatable_bonds: | 8 |
MolWt: | 767.01 | Num_heavy_atoms: | 54 |
TPSA: | 198.76 | NumAromaticRings: | 0 |
Unique Aglycone
AD00331
Formula: C30H50O2
Smiles:
C=C(C)C1CCC2(CO)CCC3(C)C(CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C12HBA: | 2 | RingCount: | 5 |
HBD: | 2 | FractionCSP3: | 0.93 |
AlogP: | 7.0 | Num_rotatable_bonds: | 2 |
MolWt: | 442.73 | Num_heavy_atoms: | 32 |
TPSA: | 40.46 | NumAromaticRings: | 0 |