Glycoside
...
GD012033

Name:
None

Formula:
C32H59O12N5

Smiles:
COC(=O)[C@H](CC(C)C)NC(=O)[C@H](NC(=O)CCOC[C@@H]1O[C@H](OCCCNC(=O)[C@H](NC(=O)[C@H](C)N)C(C)C)[C@H](O)[C@H](O)[C@H]1O)C(C)C

Aglycone:
CC(N)C(=O)NC(C(=O)NCCCO)C(C)C.COCCC(=O)NC(C(=O)NC(CC(C)C)C(=O)OC)C(C)C

Sugarmoiety:
OC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 17 RingCount: 1
HBD: 9 FractionCSP3: 0.84
AlogP: -1.94 Num_rotatable_bonds: 21
MolWt: 705.85 Num_heavy_atoms: 49
TPSA: 257.1 NumAromaticRings: 0

Unique Aglycone
AD00099
Formula: C11H23O3N3

Smiles:
CC(N)C(=O)NC(C(=O)NCCCO)C(C)C
HBA: 6 RingCount: 0
HBD: 5 FractionCSP3: 0.82
AlogP: -1.03 Num_rotatable_bonds: 7
MolWt: 245.32 Num_heavy_atoms: 17
TPSA: 104.45 NumAromaticRings: 0
AD09105
Formula: C16H30O5N2

Smiles:
COCCC(=O)NC(C(=O)NC(CC(C)C)C(=O)OC)C(C)C
HBA: 7 RingCount: 0
HBD: 2 FractionCSP3: 0.81
AlogP: 0.87 Num_rotatable_bonds: 10
MolWt: 330.43 Num_heavy_atoms: 23
TPSA: 93.73 NumAromaticRings: 0

Sugarmoiety
SD00017

OC1OC(O)C(O)C(O)C1O