Glycoside
...
GD115576

Name:
None

Formula:
C36H36O12N4

Smiles:
CCc1c[nH]c(C(c2ccccc2)c2c(-c3ccc(O)cc3)oc3cc(OC4OC(C(=O)O)C(O)C(O)(CNC(=N)N)C4O)c(O)c(O)c3c2=O)c1

Aglycone:
CCc1c[nH]c(C(c2ccccc2)c2c(-c3ccc(O)cc3)oc3cc(O)c(O)c(O)c3c2=O)c1.CNC(=N)N

Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)(O)C1O

Other Identifiers

Properties
HBA: 16 RingCount: 6
HBD: 12 FractionCSP3: 0.25
AlogP: 1.77 Num_rotatable_bonds: 10
MolWt: 716.7 Num_heavy_atoms: 52
TPSA: 285.04 NumAromaticRings: 5

Unique Aglycone
AD01954
Formula: C2H7N3

Smiles:
CNC(=N)N
HBA: 3 RingCount: 0
HBD: 4 FractionCSP3: 0.5
AlogP: -0.9 Num_rotatable_bonds: 0
MolWt: 73.1 Num_heavy_atoms: 5
TPSA: 61.9 NumAromaticRings: 0
AD45748
Formula: C28H23O6N

Smiles:
CCc1c[nH]c(C(c2ccccc2)c2c(-c3ccc(O)cc3)oc3cc(O)c(O)c(O)c3c2=O)c1
HBA: 7 RingCount: 5
HBD: 5 FractionCSP3: 0.11
AlogP: 5.35 Num_rotatable_bonds: 5
MolWt: 469.49 Num_heavy_atoms: 35
TPSA: 126.92 NumAromaticRings: 5

Sugarmoiety
SD04479

O=C(O)C1OC(O)C(O)C(O)(O)C1O