Glycoside
...
GD003327

Name:
None

Formula:
C39H71O14N

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@H]2O)[C@@](C)(OCCO)C[C@H](C)C(=O)[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)C2O)C(C)(OCCO)CC(C)C(=O)C(C)C(O)C1(C)O

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

Other Identifiers

Properties
HBA: 15 RingCount: 3
HBD: 5 FractionCSP3: 0.95
AlogP: 1.8 Num_rotatable_bonds: 10
MolWt: 777.99 Num_heavy_atoms: 54
TPSA: 203.14 NumAromaticRings: 0

Unique Aglycone
AD03031
Formula: C31H57O11N

Smiles:
CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(OCCO)CC(C)C(=O)C(C)C(O)C1(C)O
HBA: 12 RingCount: 2
HBD: 5 FractionCSP3: 0.94
AlogP: 0.88 Num_rotatable_bonds: 7
MolWt: 619.79 Num_heavy_atoms: 43
TPSA: 175.45 NumAromaticRings: 0

Sugarmoiety
SD00005

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