Glycoside

GD037601
Name:
PrecoseFormula:
C25H43O18NSmiles:
C[C@@H]1O[C@H](O[C@@H]2[C@H](CO)O[C@H](O[C@H]([C@H](O)CO)[C@H](O)[C@H](O)C=O)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1N[C@@H]1C=C(CO)[C@H](O)[C@H](O)[C@H]1OAglycone:
NC1C=C(CO)C(O)C(O)C1OSugarmoiety:
CC1OC(OC2C(CO)OC(OC(C(O)CO)C(O)C(O)C=O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 19 | RingCount: | 3 |
HBD: | 14 | FractionCSP3: | 0.88 |
AlogP: | -8.72 | Num_rotatable_bonds: | 13 |
MolWt: | 645.61 | Num_heavy_atoms: | 44 |
TPSA: | 329.01 | NumAromaticRings: | 0 |
Unique Aglycone
AD02201
Formula: C7H13O4N
Smiles:
NC1C=C(CO)C(O)C(O)C1OHBA: | 5 | RingCount: | 1 |
HBD: | 6 | FractionCSP3: | 0.71 |
AlogP: | -2.67 | Num_rotatable_bonds: | 1 |
MolWt: | 175.18 | Num_heavy_atoms: | 12 |
TPSA: | 106.94 | NumAromaticRings: | 0 |