Glycoside
...
GD012443

Name:
None

Formula:
C34H58O17N6

Smiles:
CC(=O)N[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H](CO)O[C@H]1O[C@H](C)[C@H](N)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(=O)N[C@H](C)C(=O)O)C(C)C

Aglycone:
CC(NC(=O)C(C)NC(=O)C1CCCN1C(=O)C(NC(=O)C(N)C(C)O)C(C)C)C(=O)O

Sugarmoiety:
CC(=O)NC1C(O)OC(CO)C(O)C1OC1OC(CO)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 23 RingCount: 3
HBD: 13 FractionCSP3: 0.82
AlogP: -6.29 Num_rotatable_bonds: 17
MolWt: 822.86 Num_heavy_atoms: 57
TPSA: 358.33 NumAromaticRings: 0

Unique Aglycone
AD09381
Formula: C20H35O7N5

Smiles:
CC(NC(=O)C(C)NC(=O)C1CCCN1C(=O)C(NC(=O)C(N)C(C)O)C(C)C)C(=O)O
HBA: 12 RingCount: 1
HBD: 7 FractionCSP3: 0.75
AlogP: -2.08 Num_rotatable_bonds: 10
MolWt: 457.53 Num_heavy_atoms: 32
TPSA: 191.16 NumAromaticRings: 0

Sugarmoiety
SD00222

CC(=O)NC1C(O)OC(CO)C(O)C1OC1OC(CO)C(O)C(O)C1O