Glycoside
...
GD029653

Name:
None

Formula:
C52H90O21N10

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]1OC[C@H](N)C(=O)N[C@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(=O)N[C@H](C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C)C(=O)O)C(C)C)C(C)C)C(C)C

Aglycone:
CC(C)CC(NC(=O)C(N)CO)C(=O)N1CCCC1C(=O)NC(C)C(=O)NC(C)C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C)C(=O)O)C(C)C)C(C)C)C(C)C

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

Other Identifiers

Properties
HBA: 31 RingCount: 3
HBD: 17 FractionCSP3: 0.81
AlogP: -6.36 Num_rotatable_bonds: 29
MolWt: 1191.34 Num_heavy_atoms: 83
TPSA: 474.73 NumAromaticRings: 0

Unique Aglycone
AD19270
Formula: C38H67O11N9

Smiles:
CC(C)CC(NC(=O)C(N)CO)C(=O)N1CCCC1C(=O)NC(C)C(=O)NC(C)C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C)C(=O)O)C(C)C)C(C)C)C(C)C
HBA: 20 RingCount: 1
HBD: 11 FractionCSP3: 0.76
AlogP: -2.15 Num_rotatable_bonds: 22
MolWt: 826.01 Num_heavy_atoms: 58
TPSA: 307.56 NumAromaticRings: 0

Sugarmoiety
SD00222

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