Glycoside

GD009518
Name:
NoneFormula:
C23H45O10N5Smiles:
NC[C@@H]1CC[C@H](N)[C@H](O[C@@H]2[C@H](CO)O[C@H](O[C@H]3[C@H](O[C@@H]4O[C@H](CO)CC[C@H]4N)[C@@H](N)C[C@@H](N)[C@H]3O)[C@H]2O)O1Aglycone:
NC1CCC(CO)OC1OC1C(N)CC(N)C(O)C1O.NCC1CCC(N)C(O)O1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
HBA: | 15 | RingCount: | 4 |
HBD: | 14 | FractionCSP3: | 1.0 |
AlogP: | -4.74 | Num_rotatable_bonds: | 9 |
MolWt: | 551.64 | Num_heavy_atoms: | 38 |
TPSA: | 266.4 | NumAromaticRings: | 0 |
Unique Aglycone
AD07456
Formula: C12H25O5N3
Smiles:
NC1CCC(CO)OC1OC1C(N)CC(N)C(O)C1OHBA: | 8 | RingCount: | 2 |
HBD: | 9 | FractionCSP3: | 1.0 |
AlogP: | -3.02 | Num_rotatable_bonds: | 3 |
MolWt: | 291.35 | Num_heavy_atoms: | 20 |
TPSA: | 157.21 | NumAromaticRings: | 0 |
AD07457
Formula: C6H14O2N2
Smiles:
NCC1CCC(N)C(O)O1HBA: | 4 | RingCount: | 1 |
HBD: | 5 | FractionCSP3: | 1.0 |
AlogP: | -1.23 | Num_rotatable_bonds: | 1 |
MolWt: | 146.19 | Num_heavy_atoms: | 10 |
TPSA: | 81.5 | NumAromaticRings: | 0 |