Glycoside
...
GD135910

Name:
None

Formula:
C43H45O13N3

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=CC21C(=O)O

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

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

Other Identifiers

Properties
HBA: 16 RingCount: 8
HBD: 9 FractionCSP3: 0.4
AlogP: 2.38 Num_rotatable_bonds: 10
MolWt: 811.84 Num_heavy_atoms: 59
TPSA: 262.63 NumAromaticRings: 3

Unique Aglycone
AD54943
Formula: C37H35O7N3

Smiles:
O=C(C=Cc1ccc(O)c(CC2=NCN=C2)c1)N1c2cc(O)c(O)cc2C2C(C3(c4ccccc4O)CCCCC3)C=CC21C(=O)O
HBA: 10 RingCount: 7
HBD: 5 FractionCSP3: 0.3
AlogP: 5.59 Num_rotatable_bonds: 7
MolWt: 633.7 Num_heavy_atoms: 47
TPSA: 163.25 NumAromaticRings: 3

Sugarmoiety
SD00999

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