Glycoside
...
GD015386

Name:
None

Formula:
C45H78O14N4

Smiles:
CC[C@@H]1OC(=O)[C@H](C)[C@H](O[C@@H]2C[C@@](C)(OC)[C@H](O)[C@H](C)O2)[C@H](C)[C@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(O)C[C@H](C)[C@H](OCC(=O)Nc2ccncn2)[C@H](C)[C@H](O)[C@]1(C)O

Aglycone:
CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C(C)C)C2O)C(C)(O)CC(C)C(OCC(=O)Nc2ccncn2)C(C)C(O)C1(C)O

Sugarmoiety:
COC1(C)CC(O)OC(C)C1O

Other Identifiers

Properties
HBA: 18 RingCount: 4
HBD: 6 FractionCSP3: 0.87
AlogP: 2.81 Num_rotatable_bonds: 12
MolWt: 899.13 Num_heavy_atoms: 63
TPSA: 240.95 NumAromaticRings: 1

Unique Aglycone
AD11188
Formula: C37H64O11N4

Smiles:
CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C(C)C)C2O)C(C)(O)CC(C)C(OCC(=O)Nc2ccncn2)C(C)C(O)C1(C)O
HBA: 15 RingCount: 3
HBD: 6 FractionCSP3: 0.84
AlogP: 1.88 Num_rotatable_bonds: 9
MolWt: 740.94 Num_heavy_atoms: 52
TPSA: 213.26 NumAromaticRings: 1

Sugarmoiety
SD00005

COC1(C)CC(O)OC(C)C1O