Glycoside

GD084934
Name:
NoneFormula:
C20H32O6N3Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)c2ccc(CC[NH+]3CCCC3)nc2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=C(NCCO)c1ccc(CC[NH+]2CCCC2)nc1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 9 | RingCount: | 3 |
HBD: | 5 | FractionCSP3: | 0.7 |
AlogP: | -2.12 | Num_rotatable_bonds: | 8 |
MolWt: | 410.49 | Num_heavy_atoms: | 29 |
TPSA: | 125.58 | NumAromaticRings: | 1 |
Unique Aglycone
AD38009
Formula: C14H22O2N3
Smiles:
O=C(NCCO)c1ccc(CC[NH+]2CCCC2)nc1HBA: | 5 | RingCount: | 2 |
HBD: | 3 | FractionCSP3: | 0.57 |
AlogP: | -0.98 | Num_rotatable_bonds: | 6 |
MolWt: | 264.35 | Num_heavy_atoms: | 19 |
TPSA: | 66.66 | NumAromaticRings: | 1 |