Glycoside

GD021675
Name:
NoneFormula:
C42H70O11Smiles:
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](C)[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:
CC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 11 | RingCount: | 7 |
HBD: | 7 | FractionCSP3: | 0.95 |
AlogP: | 3.67 | Num_rotatable_bonds: | 7 |
MolWt: | 751.01 | Num_heavy_atoms: | 53 |
TPSA: | 178.53 | 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 |