Glycoside

GD028934
Name:
NoneFormula:
C43H72O15Smiles:
CC(=O)O[C@@H]1CO[C@H](O[C@@H]2C[C@]3(C)[C@H](CC[C@@H]4[C@]5(C)CC[C@H](O)C(C)(C)[C@H]5[C@H](O)C[C@]43C)[C@]3(C)C[C@H](O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)[C@H](O)C(C)(C)[C@H]23)[C@H](O)[C@H]1OAglycone:
CC1(C)C(O)CCC2(C)C1C(O)CC1(C)C2CCC2C3(C)CC(O)C(O)C(C)(C)C3C(O)CC21CSugarmoiety:
CC(=O)OC1COC(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 15 | RingCount: | 7 |
HBD: | 9 | FractionCSP3: | 0.98 |
AlogP: | 0.99 | Num_rotatable_bonds: | 6 |
MolWt: | 829.03 | Num_heavy_atoms: | 58 |
TPSA: | 245.29 | NumAromaticRings: | 0 |
Unique Aglycone
AD18866
Formula: C30H52O5
Smiles:
CC1(C)C(O)CCC2(C)C1C(O)CC1(C)C2CCC2C3(C)CC(O)C(O)C(C)(C)C3C(O)CC21CHBA: | 5 | RingCount: | 5 |
HBD: | 5 | FractionCSP3: | 1.0 |
AlogP: | 4.13 | Num_rotatable_bonds: | 0 |
MolWt: | 492.74 | Num_heavy_atoms: | 35 |
TPSA: | 101.15 | NumAromaticRings: | 0 |