Glycoside
...
GD000649

Name:
None

Formula:
C46H71O18N

Smiles:
C[C@H]1C=CC=CC=CC=CC=CC=CC=C[C@@H](O[C@@H]2O[C@H](O)[C@H](O)[C@H](N)[C@H]2O)C[C@@H]2O[C@](O)(C[C@@H](O)C[C@@H](O)[C@@H](O)CC[C@@H](O)C[C@@H](O)CC(=O)O[C@@H](C)[C@H](C)[C@H]1O)C[C@H](O)[C@@H]2C(=O)O

Aglycone:
CC1C=CC=CC=CC=CC=CC=CC=CC(O)CC2OC(O)(CC(O)CC(O)C(O)CCC(O)CC(O)CC(=O)OC(C)C(C)C1O)CC(O)C2C(=O)O

Sugarmoiety:
NC1C(O)C(O)OC(O)C1O

Other Identifiers

Properties
HBA: 19 RingCount: 3
HBD: 14 FractionCSP3: 0.65
AlogP: -0.36 Num_rotatable_bonds: 3
MolWt: 926.06 Num_heavy_atoms: 65
TPSA: 339.84 NumAromaticRings: 0

Unique Aglycone
AD00702
Formula: C41H62O14

Smiles:
CC1C=CC=CC=CC=CC=CC=CC=CC(O)CC2OC(O)(CC(O)CC(O)C(O)CCC(O)CC(O)CC(=O)OC(C)C(C)C1O)CC(O)C2C(=O)O
HBA: 14 RingCount: 2
HBD: 10 FractionCSP3: 0.61
AlogP: 1.89 Num_rotatable_bonds: 1
MolWt: 778.93 Num_heavy_atoms: 55
TPSA: 254.9 NumAromaticRings: 0

Sugarmoiety
SD00219

NC1C(O)C(O)OC(O)C1O