Glycoside
...
GD119636

Name:
None

Formula:
C41H41O13N5

Smiles:
N=C1N=C(O)C2=NCN(c3ccccc3Cc3cc4c(c(OCC(O)CC=O)c3OC3OC(C5(O)CCCC5)C(O)C(O)C3O)C(=O)c3cc(CO)ccc3C4=O)C2=N1

Aglycone:
N=C1N=C(O)C2=NCN(c3ccccc3Cc3cc4c(c(OCC(O)CC=O)c3O)C(=O)c3cc(CO)ccc3C4=O)C2=N1.OC1CCCC1

Sugarmoiety:
OC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 18 RingCount: 8
HBD: 8 FractionCSP3: 0.39
AlogP: 0.89 Num_rotatable_bonds: 12
MolWt: 811.8 Num_heavy_atoms: 59
TPSA: 284.68 NumAromaticRings: 3

Unique Aglycone
AD45279
Formula: C5H10O

Smiles:
OC1CCCC1
HBA: 1 RingCount: 1
HBD: 1 FractionCSP3: 1.0
AlogP: 0.92 Num_rotatable_bonds: 0
MolWt: 86.13 Num_heavy_atoms: 6
TPSA: 20.23 NumAromaticRings: 0
AD46292
Formula: C31H25O8N5

Smiles:
N=C1N=C(O)C2=NCN(c3ccccc3Cc3cc4c(c(OCC(O)CC=O)c3O)C(=O)c3cc(CO)ccc3C4=O)C2=N1
HBA: 13 RingCount: 6
HBD: 5 FractionCSP3: 0.19
AlogP: 2.1 Num_rotatable_bonds: 9
MolWt: 595.57 Num_heavy_atoms: 44
TPSA: 205.53 NumAromaticRings: 3

Sugarmoiety
SD00017

OC1OC(O)C(O)C(O)C1O