Glycoside

GD026659
Name:
NoneFormula:
C25H31O8N8PSmiles:
CCOC(=O)[C@H](C)NP(=O)(OC[C@@H]1O[C@H](n2c3ncnc(N)c3c3c(N)ncnc32)[C@@](C)(O)[C@H]1O)Oc1ccccc1Aglycone:
CCOC(=O)C(C)NP(=O)(OC)Oc1ccccc1.Nc1ncnc2c1-c1c(N)ncnc1[N]2Sugarmoiety:
CC1(O)C(O)OC(O)C1OOther Identifiers
Properties
HBA: | 16 | RingCount: | 5 |
HBD: | 7 | FractionCSP3: | 0.4 |
AlogP: | 1.29 | Num_rotatable_bonds: | 10 |
MolWt: | 602.55 | Num_heavy_atoms: | 42 |
TPSA: | 232.08 | NumAromaticRings: | 4 |
Unique Aglycone
AD00514
Formula: C12H18O5NP
Smiles:
CCOC(=O)C(C)NP(=O)(OC)Oc1ccccc1HBA: | 6 | RingCount: | 1 |
HBD: | 1 | FractionCSP3: | 0.42 |
AlogP: | 2.36 | Num_rotatable_bonds: | 7 |
MolWt: | 287.25 | Num_heavy_atoms: | 19 |
TPSA: | 73.86 | NumAromaticRings: | 1 |
AD01980
Formula: C8H6N7
Smiles:
Nc1ncnc2c1-c1c(N)ncnc1[N]2HBA: | 7 | RingCount: | 3 |
HBD: | 4 | FractionCSP3: | 0.0 |
AlogP: | -0.02 | Num_rotatable_bonds: | 0 |
MolWt: | 200.18 | Num_heavy_atoms: | 15 |
TPSA: | 117.7 | NumAromaticRings: | 2 |