Glycoside

GD089445
Name:
NoneFormula:
C21H31O8N2Smiles:
CCOC(=O)C1CC[NH+](Cc2cccc(NC(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)CO)c2)CC1Aglycone:
CCOC(=O)C1CC[NH+](Cc2cccc(N)c2)CC1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
HBA: | 10 | RingCount: | 2 |
HBD: | 6 | FractionCSP3: | 0.57 |
AlogP: | -2.37 | Num_rotatable_bonds: | 10 |
MolWt: | 439.49 | Num_heavy_atoms: | 31 |
TPSA: | 157.83 | NumAromaticRings: | 1 |
Unique Aglycone
AD39019
Formula: C15H23O2N2
Smiles:
CCOC(=O)C1CC[NH+](Cc2cccc(N)c2)CC1HBA: | 4 | RingCount: | 2 |
HBD: | 3 | FractionCSP3: | 0.53 |
AlogP: | 0.63 | Num_rotatable_bonds: | 4 |
MolWt: | 263.36 | Num_heavy_atoms: | 19 |
TPSA: | 56.76 | NumAromaticRings: | 1 |