Glycoside

GD123047
Name:
K252DFormula:
C26H23O5N3Smiles:
CC1OC(n2c3ccccc3c3c4c(c5c6ccccc6[nH]c5c32)CN=C4O)C(O)C(O)C1OAglycone:
OC1=NCc2c1c1c3ccccc3[nH]c1c1[nH]c3ccccc3c21Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 8 | RingCount: | 7 |
HBD: | 5 | FractionCSP3: | 0.27 |
AlogP: | 3.25 | Num_rotatable_bonds: | 1 |
MolWt: | 457.49 | Num_heavy_atoms: | 34 |
TPSA: | 123.23 | NumAromaticRings: | 5 |
Unique Aglycone
AD49632
Formula: C20H13ON3
Smiles:
OC1=NCc2c1c1c3ccccc3[nH]c1c1[nH]c3ccccc3c21HBA: | 4 | RingCount: | 6 |
HBD: | 3 | FractionCSP3: | 0.05 |
AlogP: | 4.77 | Num_rotatable_bonds: | 0 |
MolWt: | 311.34 | Num_heavy_atoms: | 24 |
TPSA: | 64.17 | NumAromaticRings: | 5 |