Glycoside

GD031450
Name:
NoneFormula:
C28H30O7N4Smiles:
CO[C@@H]1[C@H](O)[C@H](O)[C@H](Oc2ccc3c(c2C)OC(=O)C(n2cc(-c4c[nH]c5ccccc45)nn2)C3)OC1(C)CAglycone:
Cc1c(O)ccc2c1OC(=O)C(n1cc(-c3c[nH]c4ccccc34)nn1)C2Sugarmoiety:
COC1C(O)C(O)C(O)OC1(C)COther Identifiers
Properties
HBA: | 11 | RingCount: | 6 |
HBD: | 3 | FractionCSP3: | 0.39 |
AlogP: | 2.69 | Num_rotatable_bonds: | 5 |
MolWt: | 534.57 | Num_heavy_atoms: | 39 |
TPSA: | 140.95 | NumAromaticRings: | 4 |
Unique Aglycone
AD20261
Formula: C20H16O3N4
Smiles:
Cc1c(O)ccc2c1OC(=O)C(n1cc(-c3c[nH]c4ccccc34)nn1)C2HBA: | 7 | RingCount: | 5 |
HBD: | 2 | FractionCSP3: | 0.15 |
AlogP: | 3.14 | Num_rotatable_bonds: | 2 |
MolWt: | 360.37 | Num_heavy_atoms: | 27 |
TPSA: | 93.03 | NumAromaticRings: | 4 |