Glycoside
...
GD036466

Name:
None

Formula:
C43H81O14N3

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(CCCNC(=O)COC)[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(CCCNC(=O)COC)C(C)C(O)C1(C)O

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

Other Identifiers

Properties
HBA: 17 RingCount: 3
HBD: 6 FractionCSP3: 0.95
AlogP: 1.42 Num_rotatable_bonds: 13
MolWt: 864.13 Num_heavy_atoms: 60
TPSA: 218.41 NumAromaticRings: 0

Unique Aglycone
AD22993
Formula: C35H67O11N3

Smiles:
CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)CN(CCCNC(=O)COC)C(C)C(O)C1(C)O
HBA: 14 RingCount: 2
HBD: 6 FractionCSP3: 0.94
AlogP: 0.5 Num_rotatable_bonds: 10
MolWt: 705.93 Num_heavy_atoms: 49
TPSA: 190.72 NumAromaticRings: 0

Sugarmoiety
SD00005

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