Glycoside
...
GD114151

Name:
None

Formula:
C39H45O10N5

Smiles:
CNC(=N)NCc1c(CCc2ccccc2)cc2c(c1O)C(=O)c1c(OC3OC(CO)C(O)(CCC4=CCNC(N)=C4)C(O)C3O)cc(OC)cc1C2=O

Aglycone:
CCC1=CCNC(N)=C1.CNC(=N)NCc1c(CCc2ccccc2)cc2c(c1O)C(=O)c1c(O)cc(OC)cc1C2=O

Sugarmoiety:
OCC1OC(O)C(O)C(O)C1(O)O

Other Identifiers

Properties
HBA: 15 RingCount: 6
HBD: 11 FractionCSP3: 0.36
AlogP: 0.86 Num_rotatable_bonds: 12
MolWt: 743.81 Num_heavy_atoms: 54
TPSA: 248.94 NumAromaticRings: 3

Unique Aglycone
AD44859
Formula: C7H12N2

Smiles:
CCC1=CCNC(N)=C1
HBA: 2 RingCount: 1
HBD: 3 FractionCSP3: 0.43
AlogP: 0.73 Num_rotatable_bonds: 1
MolWt: 124.19 Num_heavy_atoms: 9
TPSA: 38.05 NumAromaticRings: 0
AD44860
Formula: C26H25O5N3

Smiles:
CNC(=N)NCc1c(CCc2ccccc2)cc2c(c1O)C(=O)c1c(O)cc(OC)cc1C2=O
HBA: 8 RingCount: 4
HBD: 5 FractionCSP3: 0.19
AlogP: 2.91 Num_rotatable_bonds: 6
MolWt: 459.5 Num_heavy_atoms: 34
TPSA: 131.74 NumAromaticRings: 3

Sugarmoiety
SD04299

OCC1OC(O)C(O)C(O)C1(O)O