Glycoside
...
GD004908

Name:
None

Formula:
C54H68O18N10F4S2

Smiles:
CC(=Cc1cc(F)c(Oc2ccc(S(=O)(=O)NCCOCCOCCOCCNC(=O)[C@@H](O)[C@@H](O)C(=O)NCCOCCOCCOCCNS(=O)(=O)c3ccc(Oc4c(F)cc(C=C(C)C(=O)N=C(N)N)cc4F)cc3)cc2)c(F)c1)C(=O)N=C(N)N

Aglycone:
CC(=Cc1cc(F)c(Oc2ccc(S(=O)(=O)NCCOCCOCCOCCN)cc2)c(F)c1)C(=O)N=C(N)N.CC(=Cc1cc(F)c(Oc2ccc(S(=O)(=O)NCCOCCOCCOCCN)cc2)c(F)c1)C(=O)N=C(N)N

Sugarmoiety:
O=C(O)C(O)C(O)C(=O)O

Other Identifiers

Properties
HBA: 28 RingCount: 4
HBD: 14 FractionCSP3: 0.37
AlogP: 0.54 Num_rotatable_bonds: 39
MolWt: 1285.32 Num_heavy_atoms: 88
TPSA: 427.78 NumAromaticRings: 4

Unique Aglycone
AD04230
Formula: C25H33O7N5F2S

Smiles:
CC(=Cc1cc(F)c(Oc2ccc(S(=O)(=O)NCCOCCOCCOCCN)cc2)c(F)c1)C(=O)N=C(N)N
HBA: 12 RingCount: 2
HBD: 7 FractionCSP3: 0.36
AlogP: 1.25 Num_rotatable_bonds: 17
MolWt: 585.63 Num_heavy_atoms: 40
TPSA: 190.58 NumAromaticRings: 2

Sugarmoiety
SD00169

O=C(O)C(O)C(O)C(=O)O