Glycoside

GD028404
Name:
NoneFormula:
C32H62O8N8Smiles:
CCCCCCCCCCCCc1cn(C[C@@H]2O[C@H](O[C@H]3[C@H](N)C[C@@H](N)[C@@H](O[C@@H]4O[C@H](CN)[C@H](O)C[C@H]4N)[C@H]3O)[C@H](O)[C@H](N)[C@H]2O)nn1Aglycone:
CCCCCCCCCCCCc1cn(C)nn1.NCC1OC(OC2C(N)CC(N)C(O)C2O)C(N)CC1OSugarmoiety:
NC1C(O)C(O)OC(O)C1OOther Identifiers
Properties
HBA: | 16 | RingCount: | 4 |
HBD: | 14 | FractionCSP3: | 0.94 |
AlogP: | -1.53 | Num_rotatable_bonds: | 18 |
MolWt: | 686.9 | Num_heavy_atoms: | 48 |
TPSA: | 278.65 | NumAromaticRings: | 1 |
Unique Aglycone
AD02993
Formula: C12H26O5N4
Smiles:
NCC1OC(OC2C(N)CC(N)C(O)C2O)C(N)CC1OHBA: | 9 | RingCount: | 2 |
HBD: | 11 | FractionCSP3: | 1.0 |
AlogP: | -4.09 | Num_rotatable_bonds: | 3 |
MolWt: | 306.36 | Num_heavy_atoms: | 21 |
TPSA: | 183.23 | NumAromaticRings: | 0 |
AD11247
Formula: C15H29N3
Smiles:
CCCCCCCCCCCCc1cn(C)nn1HBA: | 3 | RingCount: | 1 |
HBD: | 0 | FractionCSP3: | 0.87 |
AlogP: | 4.28 | Num_rotatable_bonds: | 11 |
MolWt: | 251.42 | Num_heavy_atoms: | 18 |
TPSA: | 30.71 | NumAromaticRings: | 1 |