Glycoside
...
GD022682

Name:
None

Formula:
C43H46O17N8

Smiles:
COc1ccc2c(c1)Oc1cc(O)ccc1C2=C1C=CC(=Nc2nc(O)nc(OCC3OC(O)C(NC(C)=O)C(O[C@H](C)C(=O)N[C@H](C)C(=O)N[C@H](CCC(=O)O)C(N)=O)C3O)n2)C=C1C(=O)O

Aglycone:
CC(O)C(=O)NC(C)C(=O)NC(CCC(=O)O)C(N)=O.COc1ccc2c(c1)Oc1cc(O)ccc1C2=C1C=CC(=Nc2nc(O)nc(OC)n2)C=C1C(=O)O

Sugarmoiety:
CC(=O)NC1C(O)OC(O)C(O)C1O

Other Identifiers

Properties
HBA: 25 RingCount: 6
HBD: 11 FractionCSP3: 0.35
AlogP: -0.37 Num_rotatable_bonds: 17
MolWt: 946.88 Num_heavy_atoms: 68
TPSA: 383.09 NumAromaticRings: 3

Unique Aglycone
AD00987
Formula: C11H19O6N3

Smiles:
CC(O)C(=O)NC(C)C(=O)NC(CCC(=O)O)C(N)=O
HBA: 9 RingCount: 0
HBD: 6 FractionCSP3: 0.64
AlogP: -2.29 Num_rotatable_bonds: 8
MolWt: 289.29 Num_heavy_atoms: 20
TPSA: 158.82 NumAromaticRings: 0
AD15351
Formula: C25H18O7N4

Smiles:
COc1ccc2c(c1)Oc1cc(O)ccc1C2=C1C=CC(=Nc2nc(O)nc(OC)n2)C=C1C(=O)O
HBA: 11 RingCount: 5
HBD: 3 FractionCSP3: 0.08
AlogP: 3.56 Num_rotatable_bonds: 4
MolWt: 486.44 Num_heavy_atoms: 36
TPSA: 156.48 NumAromaticRings: 3

Sugarmoiety
SD00020

CC(=O)NC1C(O)OC(O)C(O)C1O