Glycoside
...
GD154270

Name:
None

Formula:
C53H57O15N3

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(CCC(O)c3ccc(CO)cc3)=CC21C(=O)O

Aglycone:
O=C(C=Cc1ccc(O)c(CC2=NCN=C2)c1)N1c2cc(O)c(O)cc2C2C(C3(c4ccccc4O)CCCCC3)C(CCC(O)c3ccc(CO)cc3)=CC21C(=O)O

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

Other Identifiers

Properties
HBA: 18 RingCount: 9
HBD: 11 FractionCSP3: 0.4
AlogP: 3.76 Num_rotatable_bonds: 15
MolWt: 976.04 Num_heavy_atoms: 71
TPSA: 303.09 NumAromaticRings: 4

Unique Aglycone
AD61295
Formula: C47H47O9N3

Smiles:
O=C(C=Cc1ccc(O)c(CC2=NCN=C2)c1)N1c2cc(O)c(O)cc2C2C(C3(c4ccccc4O)CCCCC3)C(CCC(O)c3ccc(CO)cc3)=CC21C(=O)O
HBA: 12 RingCount: 8
HBD: 7 FractionCSP3: 0.32
AlogP: 6.97 Num_rotatable_bonds: 12
MolWt: 797.9 Num_heavy_atoms: 59
TPSA: 203.71 NumAromaticRings: 4

Sugarmoiety
SD00999

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