Glycoside
...
GD005041

Name:
None

Formula:
C43H75O11N3

Smiles:
CO[C@@]1(C)C[C@H](O[C@H]2[C@H](C)C(=O)O[C@@H](COCc3ccccc3)CN(C)C[C@@H](C)[C@@H](N)[C@@H](C)C[C@](C)(O)[C@@H](O[C@@H]3O[C@H](C)C[C@H](N(C)C)[C@H]3O)[C@H]2C)O[C@H](C)[C@H]1O

Aglycone:
CC1CC(N(C)C)C(O)C(OC2C(C)C(O)C(C)C(=O)OC(COCc3ccccc3)CN(C)CC(C)C(N)C(C)CC2(C)O)O1

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

Other Identifiers

Properties
HBA: 14 RingCount: 4
HBD: 5 FractionCSP3: 0.84
AlogP: 3.17 Num_rotatable_bonds: 10
MolWt: 810.08 Num_heavy_atoms: 57
TPSA: 174.87 NumAromaticRings: 1

Unique Aglycone
AD04319
Formula: C35H61O8N3

Smiles:
CC1CC(N(C)C)C(O)C(OC2C(C)C(O)C(C)C(=O)OC(COCc3ccccc3)CN(C)CC(C)C(N)C(C)CC2(C)O)O1
HBA: 11 RingCount: 3
HBD: 5 FractionCSP3: 0.8
AlogP: 2.25 Num_rotatable_bonds: 7
MolWt: 651.89 Num_heavy_atoms: 46
TPSA: 147.18 NumAromaticRings: 1

Sugarmoiety
SD00005

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