Glycoside
...
GD011328

Name:
None

Formula:
C41H79O12N3

Smiles:
CC[C@@H]1OC(=O)[C@H](C)[C@H](OC2CC(C)(OC)C(O)C(C)O2)[C@H](C)[C@H](OC2OC(C)CC(N(C)C)C2O)[C@@](C)(O)C[C@H](C)[C@H](NCCCCN)[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)(O)CC(C)C(NCCCCN)C(C)C(O)C1(C)O

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

Other Identifiers

Properties
HBA: 15 RingCount: 3
HBD: 8 FractionCSP3: 0.98
AlogP: 1.91 Num_rotatable_bonds: 12
MolWt: 806.09 Num_heavy_atoms: 56
TPSA: 214.89 NumAromaticRings: 0

Unique Aglycone
AD08668
Formula: C33H65O9N3

Smiles:
CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)C(NCCCCN)C(C)C(O)C1(C)O
HBA: 12 RingCount: 2
HBD: 8 FractionCSP3: 0.97
AlogP: 0.99 Num_rotatable_bonds: 9
MolWt: 647.9 Num_heavy_atoms: 45
TPSA: 187.2 NumAromaticRings: 0

Sugarmoiety
SD00005

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