Glycoside
...
GD004614

Name:
None

Formula:
C23H34O9N5P

Smiles:
CC(=O)OC[C@@H]1O[C@H](n2ccc(NP(=O)(N3CC3(C)C)N3CC3(C)C)nc2=O)[C@H](OC(C)=O)[C@H]1OC(C)=O

Aglycone:
CC1(C)CN1P(=O)(Nc1cc[nH]c(=O)n1)N1CC1(C)C.COC(C)=O

Sugarmoiety:
CC(=O)OC1C(O)OC(O)C1OC(C)=O

Other Identifiers

Properties
HBA: 14 RingCount: 4
HBD: 1 FractionCSP3: 0.7
AlogP: 1.28 Num_rotatable_bonds: 9
MolWt: 555.53 Num_heavy_atoms: 38
TPSA: 158.14 NumAromaticRings: 1

Unique Aglycone
AD00017
Formula: C3H6O2

Smiles:
COC(C)=O
HBA: 2 RingCount: 0
HBD: 0 FractionCSP3: 0.67
AlogP: 0.18 Num_rotatable_bonds: 0
MolWt: 74.08 Num_heavy_atoms: 5
TPSA: 26.3 NumAromaticRings: 0
AD04005
Formula: C12H20O2N5P

Smiles:
CC1(C)CN1P(=O)(Nc1cc[nH]c(=O)n1)N1CC1(C)C
HBA: 7 RingCount: 3
HBD: 2 FractionCSP3: 0.67
AlogP: 1.48 Num_rotatable_bonds: 4
MolWt: 297.3 Num_heavy_atoms: 20
TPSA: 80.87 NumAromaticRings: 1

Sugarmoiety
SD00105

CC(=O)OC1C(O)OC(O)C1OC(C)=O