Glycoside
...
GD021720

Name:
None

Formula:
C35H46O14N6

Smiles:
CC(C)C[C@H](NC(=O)N[C@@H]1O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]1O)C(=O)N[C@H](Cc1ccccc1)C(=O)NCC(=O)NCC(=O)N[C@H](Cc1ccc(O)cc1)C(=O)O

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

Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 20 RingCount: 3
HBD: 12 FractionCSP3: 0.46
AlogP: -2.93 Num_rotatable_bonds: 18
MolWt: 774.78 Num_heavy_atoms: 55
TPSA: 322.28 NumAromaticRings: 2

Unique Aglycone
AD03078
Formula: C29H38O8N6

Smiles:
CC(C)CC(NC(N)=O)C(=O)NC(Cc1ccccc1)C(=O)NCC(=O)NCC(=O)NC(Cc1ccc(O)cc1)C(=O)O
HBA: 14 RingCount: 2
HBD: 9 FractionCSP3: 0.38
AlogP: -0.45 Num_rotatable_bonds: 16
MolWt: 598.66 Num_heavy_atoms: 43
TPSA: 229.05 NumAromaticRings: 2

Sugarmoiety
SD00030

O=C(O)C1OC(O)C(O)C(O)C1O