Glycoside
...
GD035815

Name:
None

Formula:
C28H34O9N7P

Smiles:
CC(C)(C)OC(=O)[C@H](Cc1ccccc1)NP(=O)(OC[C@]1(N=[N+]=[N-])O[C@H](n2ccc(N)nc2=O)[C@H](O)[C@H]1O)Oc1ccccc1

Aglycone:
COP(=O)(NC(Cc1ccccc1)C(=O)OC(C)(C)C)Oc1ccccc1.Nc1cc[nH]c(=O)n1

Sugarmoiety:
[N-]=[N+]=NC1(O)OC(O)C(O)C1O

Other Identifiers

Properties
HBA: 16 RingCount: 4
HBD: 5 FractionCSP3: 0.39
AlogP: 2.83 Num_rotatable_bonds: 12
MolWt: 643.59 Num_heavy_atoms: 45
TPSA: 233.22 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
AD22640
Formula: C20H26O5NP

Smiles:
COP(=O)(NC(Cc1ccccc1)C(=O)OC(C)(C)C)Oc1ccccc1
HBA: 6 RingCount: 2
HBD: 1 FractionCSP3: 0.35
AlogP: 4.36 Num_rotatable_bonds: 8
MolWt: 391.4 Num_heavy_atoms: 27
TPSA: 73.86 NumAromaticRings: 2

Sugarmoiety
SD00111

[N-]=[N+]=NC1(O)OC(O)C(O)C1O