Glycoside
...
GD010899

Name:
None

Formula:
C28H38O11N5P

Smiles:
CCOC(=O)[C@H](C)NP(=O)(OC[C@@H]1O[C@H](n2ccc(N)nc2=O)[C@@](C)(O)[C@H]1O)Oc1ccc2c(ccn2C(=O)OC(C)(C)C)c1

Aglycone:
CCOC(=O)C(C)NP(=O)(OC)Oc1ccc2c(ccn2C(=O)OC(C)(C)C)c1.Nc1cc[nH]c(=O)n1

Sugarmoiety:
CC1(O)C(O)OC(O)C1O

Other Identifiers

Properties
HBA: 16 RingCount: 4
HBD: 5 FractionCSP3: 0.5
AlogP: 2.32 Num_rotatable_bonds: 10
MolWt: 651.61 Num_heavy_atoms: 45
TPSA: 215.69 NumAromaticRings: 3

Unique Aglycone
AD00115
Formula: C4H5ON3

Smiles:
Nc1cc[nH]c(=O)n1
HBA: 4 RingCount: 1
HBD: 3 FractionCSP3: 0.0
AlogP: -0.65 Num_rotatable_bonds: 0
MolWt: 111.1 Num_heavy_atoms: 8
TPSA: 71.77 NumAromaticRings: 1
AD08362
Formula: C19H27O7N2P

Smiles:
CCOC(=O)C(C)NP(=O)(OC)Oc1ccc2c(ccn2C(=O)OC(C)(C)C)c1
HBA: 9 RingCount: 2
HBD: 1 FractionCSP3: 0.47
AlogP: 4.1 Num_rotatable_bonds: 7
MolWt: 426.41 Num_heavy_atoms: 29
TPSA: 105.09 NumAromaticRings: 2

Sugarmoiety
SD00027

CC1(O)C(O)OC(O)C1O