Glycoside
...
GD020265

Name:
None

Formula:
C46H65O18N7

Smiles:
CC(=O)O[C@@H]1[C@H](COC(=O)[C@H](CO)NC(=O)[C@H](NC(=O)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](C)NC(=O)[C@H](N)Cc2ccc(O)cc2)C(C)C)C(C)C)O[C@H](O)[C@H](O)[C@H]1O

Aglycone:
COC(=O)C(CO)NC(=O)C(NC(=O)C(NC(=O)C(CC(=O)O)NC(=O)C(Cc1ccccc1)NC(=O)C(C)NC(=O)C(N)Cc1ccc(O)cc1)C(C)C)C(C)C

Sugarmoiety:
CC(=O)OC1C(O)OC(O)C(O)C1O

Other Identifiers

Properties
HBA: 25 RingCount: 3
HBD: 14 FractionCSP3: 0.54
AlogP: -3.87 Num_rotatable_bonds: 25
MolWt: 1004.06 Num_heavy_atoms: 71
TPSA: 400.9 NumAromaticRings: 2

Unique Aglycone
AD07578
Formula: C39H55O12N7

Smiles:
COC(=O)C(CO)NC(=O)C(NC(=O)C(NC(=O)C(CC(=O)O)NC(=O)C(Cc1ccccc1)NC(=O)C(C)NC(=O)C(N)Cc1ccc(O)cc1)C(C)C)C(C)C
HBA: 19 RingCount: 2
HBD: 11 FractionCSP3: 0.49
AlogP: -1.61 Num_rotatable_bonds: 22
MolWt: 813.91 Num_heavy_atoms: 58
TPSA: 304.68 NumAromaticRings: 2

Sugarmoiety
SD00776

CC(=O)OC1C(O)OC(O)C(O)C1O