Glycoside

GD026095
Name:
NoneFormula:
C32H54O22N2Smiles:
CC(=O)N[C@@H]1[C@H](O)C[C@](O[C@@H]2[C@H](O)[C@H](O[C@@H]3[C@H](CO)O[C@H](O)[C@H](NC(C)=O)[C@H]3O[C@@H]3O[C@H](C)[C@H](O)[C@H](O)[C@H]3O)O[C@H](CO)[C@H]2O)(C(=O)O)C[C@H]1[C@H](O)[C@H](O)COAglycone:
CC(=O)NC1C(O)CC(O)(C(=O)O)CC1C(O)C(O)COSugarmoiety:
CC(=O)NC1C(O)OC(CO)C(OC2OC(CO)C(O)C(O)C2O)C1OC1OC(C)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 24 | RingCount: | 4 |
HBD: | 15 | FractionCSP3: | 0.91 |
AlogP: | -8.56 | Num_rotatable_bonds: | 14 |
MolWt: | 818.78 | Num_heavy_atoms: | 56 |
TPSA: | 393.64 | NumAromaticRings: | 0 |
Unique Aglycone
AD17228
Formula: C12H21O8N
Smiles:
CC(=O)NC1C(O)CC(O)(C(=O)O)CC1C(O)C(O)COHBA: | 9 | RingCount: | 1 |
HBD: | 7 | FractionCSP3: | 0.83 |
AlogP: | -3.21 | Num_rotatable_bonds: | 5 |
MolWt: | 307.3 | Num_heavy_atoms: | 21 |
TPSA: | 167.55 | NumAromaticRings: | 0 |