Glycoside
...
GD147907

Name:
None

Formula:
C41H47O12N5

Smiles:
NC1N=C(O)C2NCN(c3ccccc3Cc3cc4c(c(OCC(O)CC=O)c3OC3OC(C5(O)CCCCC5)C(O)C(O)C3O)C(=O)c3ccccc3C4=O)C2N1

Aglycone:
NC1N=C(O)C2NCN(c3ccccc3Cc3cc4c(c(OCC(O)CC=O)c3O)C(=O)c3ccccc3C4=O)C2N1.OC1CCCCC1

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

Other Identifiers

Properties
HBA: 17 RingCount: 8
HBD: 10 FractionCSP3: 0.46
AlogP: 0.13 Num_rotatable_bonds: 11
MolWt: 801.85 Num_heavy_atoms: 58
TPSA: 265.96 NumAromaticRings: 3

Unique Aglycone
AD06056
Formula: C6H12O

Smiles:
OC1CCCCC1
HBA: 1 RingCount: 1
HBD: 1 FractionCSP3: 1.0
AlogP: 1.31 Num_rotatable_bonds: 0
MolWt: 100.16 Num_heavy_atoms: 7
TPSA: 20.23 NumAromaticRings: 0
AD47760
Formula: C30H29O7N5

Smiles:
NC1N=C(O)C2NCN(c3ccccc3Cc3cc4c(c(OCC(O)CC=O)c3O)C(=O)c3ccccc3C4=O)C2N1
HBA: 12 RingCount: 6
HBD: 7 FractionCSP3: 0.27
AlogP: 0.95 Num_rotatable_bonds: 8
MolWt: 571.59 Num_heavy_atoms: 42
TPSA: 186.81 NumAromaticRings: 3

Sugarmoiety
SD00017

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