Glycoside
...
GD013849

Name:
None

Formula:
C40H59O12N5

Smiles:
CC[C@@H]1OC(=O)[C@H](C)C(=O)[C@H](C)[C@H](O[C@@H]2O[C@H](C)[C@H](O)[C@H](O)[C@H]2O)[C@@](C)(OC)C[C@H](C)C(=O)[C@H](C)[C@@H]2N(CCCCn3cc(-c4ccccn4)nn3)C(=O)O[C@]12C

Aglycone:
CCC1OC(=O)C(C)C(=O)C(C)C(O)C(C)(OC)CC(C)C(=O)C(C)C2N(CCCCn3cc(-c4ccccn4)nn3)C(=O)OC12C

Sugarmoiety:
CC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 17 RingCount: 5
HBD: 3 FractionCSP3: 0.72
AlogP: 2.73 Num_rotatable_bonds: 10
MolWt: 801.93 Num_heavy_atoms: 57
TPSA: 221.96 NumAromaticRings: 2

Unique Aglycone
AD01156
Formula: C34H49O8N5

Smiles:
CCC1OC(=O)C(C)C(=O)C(C)C(O)C(C)(OC)CC(C)C(=O)C(C)C2N(CCCCn3cc(-c4ccccn4)nn3)C(=O)OC12C
HBA: 13 RingCount: 4
HBD: 1 FractionCSP3: 0.68
AlogP: 3.87 Num_rotatable_bonds: 8
MolWt: 655.79 Num_heavy_atoms: 47
TPSA: 163.04 NumAromaticRings: 2

Sugarmoiety
SD00076

CC1OC(O)C(O)C(O)C1O