Glycoside
...
GD021198

Name:
None

Formula:
C41H78O13N2

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](OCCN)[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(OCCN)C(C)C(O)C1(C)O

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

Other Identifiers

Properties
HBA: 15 RingCount: 3
HBD: 7 FractionCSP3: 0.98
AlogP: 2.34 Num_rotatable_bonds: 11
MolWt: 807.08 Num_heavy_atoms: 56
TPSA: 212.09 NumAromaticRings: 0

Unique Aglycone
AD14523
Formula: C33H64O10N2

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(OCCN)C(C)C(O)C1(C)O
HBA: 12 RingCount: 2
HBD: 7 FractionCSP3: 0.97
AlogP: 1.41 Num_rotatable_bonds: 8
MolWt: 648.88 Num_heavy_atoms: 45
TPSA: 184.4 NumAromaticRings: 0

Sugarmoiety
SD00005

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