Glycoside
...
GD015136

Name:
None

Formula:
C44H82O12N2

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)(O)C[C@H](C)CN(CC2CCCCC2)[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)CN(CC2CCCCC2)C(C)C(O)C1(C)O

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

Other Identifiers

Properties
HBA: 14 RingCount: 4
HBD: 5 FractionCSP3: 0.98
AlogP: 3.85 Num_rotatable_bonds: 9
MolWt: 831.14 Num_heavy_atoms: 58
TPSA: 180.08 NumAromaticRings: 0

Unique Aglycone
AD11038
Formula: C36H68O9N2

Smiles:
CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)CN(CC2CCCCC2)C(C)C(O)C1(C)O
HBA: 11 RingCount: 3
HBD: 5 FractionCSP3: 0.97
AlogP: 2.93 Num_rotatable_bonds: 6
MolWt: 672.95 Num_heavy_atoms: 47
TPSA: 152.39 NumAromaticRings: 0

Sugarmoiety
SD00005

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