Glycoside
...
GD010282

Name:
None

Formula:
C56H90O22N10

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](Cc1ccc(O)cc1)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(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(C)NC(=O)C(C)NC(=O)C1CCCN1C(=O)C(Cc1ccc(O)cc1)NC(=O)C(N)C(C)O)C(C)C)C(C)C)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: 32 RingCount: 4
HBD: 18 FractionCSP3: 0.71
AlogP: -6.07 Num_rotatable_bonds: 29
MolWt: 1255.38 Num_heavy_atoms: 88
TPSA: 494.96 NumAromaticRings: 1

Unique Aglycone
AD07968
Formula: C42H67O12N9

Smiles:
CC(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(C)NC(=O)C(C)NC(=O)C1CCCN1C(=O)C(Cc1ccc(O)cc1)NC(=O)C(N)C(C)O)C(C)C)C(C)C)C(C)C)C(=O)O
HBA: 21 RingCount: 2
HBD: 12 FractionCSP3: 0.64
AlogP: -1.86 Num_rotatable_bonds: 22
MolWt: 890.05 Num_heavy_atoms: 63
TPSA: 327.79 NumAromaticRings: 1

Sugarmoiety
SD00222

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