Glycoside
...
GD014202

Name:
None

Formula:
C49H78O15N2

Smiles:
CCOC(=O)[C@@H]1[C@H](C)O[C@H](O[C@@H]2[C@H](C)O[C@H](O[C@H]3[C@H](CC=O)C[C@@H](C)[C@@H](O)CN(C)CCC[C@@H](CC=Cc4ccccc4)OC(=O)C[C@@H](OC(=O)CC)[C@H]3OC)[C@H](O)[C@H]2N(C)C)C[C@]1(C)O

Aglycone:
CCC(=O)OC1CC(=O)OC(CC=Cc2ccccc2)CCCN(C)CC(O)C(C)CC(CC=O)C(O)C1OC.CCOC(=O)C1C(C)OC(O)CC1(C)O

Sugarmoiety:
CC1OC(O)C(O)C(N(C)C)C1O

Other Identifiers

Properties
HBA: 17 RingCount: 4
HBD: 3 FractionCSP3: 0.76
AlogP: 3.92 Num_rotatable_bonds: 15
MolWt: 935.16 Num_heavy_atoms: 66
TPSA: 209.29 NumAromaticRings: 1

Unique Aglycone
AD00920
Formula: C10H18O5

Smiles:
CCOC(=O)C1C(C)OC(O)CC1(C)O
HBA: 5 RingCount: 1
HBD: 2 FractionCSP3: 0.9
AlogP: 0.04 Num_rotatable_bonds: 2
MolWt: 218.25 Num_heavy_atoms: 15
TPSA: 75.99 NumAromaticRings: 0
AD10479
Formula: C31H47O8N

Smiles:
CCC(=O)OC1CC(=O)OC(CC=Cc2ccccc2)CCCN(C)CC(O)C(C)CC(CC=O)C(O)C1OC
HBA: 9 RingCount: 2
HBD: 2 FractionCSP3: 0.65
AlogP: 3.41 Num_rotatable_bonds: 8
MolWt: 561.72 Num_heavy_atoms: 40
TPSA: 122.6 NumAromaticRings: 1

Sugarmoiety
SD00048

CC1OC(O)C(O)C(N(C)C)C1O