Glycoside
...
GD034762

Name:
None

Formula:
C48H80O14N6

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)Cc3ccc(-c4cn(CC(=O)NO)nn4)cc3)[C@H]2O)[C@@](C)(O)C[C@H](C)CN(C)[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)Cc3ccc(-c4cn(CC(=O)NO)nn4)cc3)C2O)C(C)(O)CC(C)CN(C)C(C)C(O)C1(C)O

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

Other Identifiers

Properties
HBA: 20 RingCount: 5
HBD: 7 FractionCSP3: 0.79
AlogP: 2.24 Num_rotatable_bonds: 12
MolWt: 965.2 Num_heavy_atoms: 68
TPSA: 260.12 NumAromaticRings: 2

Unique Aglycone
AD22063
Formula: C40H66O11N6

Smiles:
CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)Cc3ccc(-c4cn(CC(=O)NO)nn4)cc3)C2O)C(C)(O)CC(C)CN(C)C(C)C(O)C1(C)O
HBA: 17 RingCount: 4
HBD: 7 FractionCSP3: 0.75
AlogP: 1.31 Num_rotatable_bonds: 9
MolWt: 807.0 Num_heavy_atoms: 57
TPSA: 232.43 NumAromaticRings: 2

Sugarmoiety
SD00005

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