Glycoside
...
GD125240

Name:
None

Formula:
C43H48O13N4

Smiles:
O=C(O)C1C(CC23CCCCC2(CO)CNc2ccccc23)c2cc(O)c(OC3(O)OC(CO)C(O)C(O)C3O)cc2N1C(=O)C=Cc1ccc(O)c(CC2=NCN=C2)c1

Aglycone:
O=C(O)C1C(CC23CCCCC2(CO)CNc2ccccc23)c2cc(O)c(O)cc2N1C(=O)C=Cc1ccc(O)c(CC2=NCN=C2)c1

Sugarmoiety:
OCC1OC(O)(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 17 RingCount: 8
HBD: 10 FractionCSP3: 0.44
AlogP: 1.52 Num_rotatable_bonds: 11
MolWt: 828.87 Num_heavy_atoms: 60
TPSA: 274.66 NumAromaticRings: 3

Unique Aglycone
AD50647
Formula: C37H38O7N4

Smiles:
O=C(O)C1C(CC23CCCCC2(CO)CNc2ccccc23)c2cc(O)c(O)cc2N1C(=O)C=Cc1ccc(O)c(CC2=NCN=C2)c1
HBA: 11 RingCount: 7
HBD: 6 FractionCSP3: 0.35
AlogP: 4.73 Num_rotatable_bonds: 8
MolWt: 650.73 Num_heavy_atoms: 48
TPSA: 175.28 NumAromaticRings: 3

Sugarmoiety
SD00999

OCC1OC(O)(O)C(O)C(O)C1O