Glycoside
...
GD110436

Name:
None

Formula:
C35H48O10N2

Smiles:
C[C@H]1CCC[N@@H+](Cc2c(O)c(C[N@@H+]3CCC[C@@H](C)C3)c(O)c3c(=O)c(-c4ccc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc4)coc23)C1

Aglycone:
CC1CCC[NH+](Cc2c(O)c(C[NH+]3CCCC(C)C3)c3occ(-c4ccc(O)cc4)c(=O)c3c2O)C1

Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 12 RingCount: 6
HBD: 8 FractionCSP3: 0.57
AlogP: -0.32 Num_rotatable_bonds: 8
MolWt: 656.77 Num_heavy_atoms: 47
TPSA: 178.93 NumAromaticRings: 3

Unique Aglycone
AD44636
Formula: C29H38O5N2

Smiles:
CC1CCC[NH+](Cc2c(O)c(C[NH+]3CCCC(C)C3)c3occ(-c4ccc(O)cc4)c(=O)c3c2O)C1
HBA: 7 RingCount: 5
HBD: 5 FractionCSP3: 0.48
AlogP: 2.21 Num_rotatable_bonds: 5
MolWt: 494.63 Num_heavy_atoms: 36
TPSA: 99.78 NumAromaticRings: 3

Sugarmoiety
SD00003

OCC1OC(O)C(O)C(O)C1O