Glycoside
...
GD120075

Name:
None

Formula:
C50H57O14N3

Smiles:
O=C(C=Cc1ccc(O)c(CC2=NCN=C2)c1)N1c2cc(OC3(O)OC(CO)C(O)C(O)C3O)c(O)cc2C2C(C3(c4ccccc4O)CCCCC3)C(CCC3(O)CCCC3)=CC21C(=O)O

Aglycone:
O=C(C=Cc1ccc(O)c(CC2=NCN=C2)c1)N1c2cc(O)c(O)cc2C2C(C3(c4ccccc4O)CCCCC3)C(CCC3(O)CCCC3)=CC21C(=O)O

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

Other Identifiers

Properties
HBA: 17 RingCount: 9
HBD: 10 FractionCSP3: 0.48
AlogP: 3.84 Num_rotatable_bonds: 13
MolWt: 924.01 Num_heavy_atoms: 67
TPSA: 282.86 NumAromaticRings: 3

Unique Aglycone
AD48191
Formula: C44H47O8N3

Smiles:
O=C(C=Cc1ccc(O)c(CC2=NCN=C2)c1)N1c2cc(O)c(O)cc2C2C(C3(c4ccccc4O)CCCCC3)C(CCC3(O)CCCC3)=CC21C(=O)O
HBA: 11 RingCount: 8
HBD: 6 FractionCSP3: 0.41
AlogP: 7.05 Num_rotatable_bonds: 10
MolWt: 745.87 Num_heavy_atoms: 55
TPSA: 183.48 NumAromaticRings: 3

Sugarmoiety
SD00999

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