Glycoside
...
GD033208

Name:
None

Formula:
C37H50O10N8

Smiles:
CN(C)CCCN1C(=O)c2ccc3c4c(c(NCCCn5cc(CCO[C@@H]6O[C@H](CO)[C@H](O)[C@H](O)[C@H]6O)nn5)cc(c24)C1=O)C(=O)N(CCCN(C)C)C3=O

Aglycone:
CN(C)CCCN1C(=O)c2ccc3c4c(c(NCCCn5cc(CCO)nn5)cc(c24)C1=O)C(=O)N(CCCN(C)C)C3=O

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

Other Identifiers

Properties
HBA: 18 RingCount: 6
HBD: 5 FractionCSP3: 0.57
AlogP: -0.61 Num_rotatable_bonds: 18
MolWt: 766.85 Num_heavy_atoms: 55
TPSA: 223.36 NumAromaticRings: 3

Unique Aglycone
AD16940
Formula: C31H40O5N8

Smiles:
CN(C)CCCN1C(=O)c2ccc3c4c(c(NCCCn5cc(CCO)nn5)cc(c24)C1=O)C(=O)N(CCCN(C)C)C3=O
HBA: 13 RingCount: 5
HBD: 2 FractionCSP3: 0.48
AlogP: 1.56 Num_rotatable_bonds: 15
MolWt: 604.71 Num_heavy_atoms: 44
TPSA: 144.21 NumAromaticRings: 3

Sugarmoiety
SD00003

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