Glycoside

GD030364
Name:
NoneFormula:
C40H66O14Smiles:
C[C@]1(O)CC[C@@]2(C(=O)O)CC[C@]3(C)[C@H](CC[C@H]4[C@]5(C)CC[C@@H](O)[C@@](C)(CO[C@@H]6O[C@H](CO)[C@H](O)[C@H](O[C@@H]7OC[C@H](O)[C@H](O)[C@H]7O)[C@H]6O)[C@@H]5CC[C@]43C)[C@@H]2C1Aglycone:
CC1(O)CCC2(C(=O)O)CCC3(C)C(CCC4C5(C)CCC(O)C(C)(CO)C5CCC43C)C2C1Sugarmoiety:
OCC1OC(O)C(O)C(OC2OCC(O)C(O)C2O)C1OOther Identifiers
Properties
HBA: | 14 | RingCount: | 7 |
HBD: | 9 | FractionCSP3: | 0.97 |
AlogP: | 1.3 | Num_rotatable_bonds: | 7 |
MolWt: | 770.95 | Num_heavy_atoms: | 54 |
TPSA: | 236.06 | NumAromaticRings: | 0 |
Unique Aglycone
AD10015
Formula: C29H48O5
Smiles:
CC1(O)CCC2(C(=O)O)CCC3(C)C(CCC4C5(C)CCC(O)C(C)(CO)C5CCC43C)C2C1HBA: | 5 | RingCount: | 5 |
HBD: | 4 | FractionCSP3: | 0.97 |
AlogP: | 5.01 | Num_rotatable_bonds: | 2 |
MolWt: | 476.7 | Num_heavy_atoms: | 34 |
TPSA: | 97.99 | NumAromaticRings: | 0 |