Glycoside

GD031245
Name:
NoneFormula:
C20H30O10N5PSmiles:
CCOP(=O)(CC(=O)OC[C@@H]1O[C@H](n2cnc3c(=O)[nH]c(NC(=O)C(C)C)nc32)[C@H](O)[C@H]1O)OCCAglycone:
CC(C)C(=O)Nc1nc2c(c(=O)[nH]1)N=C[N]2.CCOP(=O)(CC(=O)OC)OCCSugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
HBA: | 15 | RingCount: | 3 |
HBD: | 4 | FractionCSP3: | 0.65 |
AlogP: | 0.14 | Num_rotatable_bonds: | 11 |
MolWt: | 531.46 | Num_heavy_atoms: | 36 |
TPSA: | 204.19 | NumAromaticRings: | 2 |
Unique Aglycone
AD03777
Formula: C9H10O2N5
Smiles:
CC(C)C(=O)Nc1nc2c(c(=O)[nH]1)N=C[N]2HBA: | 7 | RingCount: | 2 |
HBD: | 2 | FractionCSP3: | 0.33 |
AlogP: | 0.27 | Num_rotatable_bonds: | 2 |
MolWt: | 220.21 | Num_heavy_atoms: | 16 |
TPSA: | 101.31 | NumAromaticRings: | 1 |
AD07583
Formula: C7H15O5P
Smiles:
CCOP(=O)(CC(=O)OC)OCCHBA: | 5 | RingCount: | 0 |
HBD: | 0 | FractionCSP3: | 0.86 |
AlogP: | 1.43 | Num_rotatable_bonds: | 6 |
MolWt: | 210.17 | Num_heavy_atoms: | 13 |
TPSA: | 61.83 | NumAromaticRings: | 0 |