Glycoside
...
GD116950

Name:
None

Formula:
C34H41O11N5

Smiles:
CNC(=N)NCc1c(CCC=O)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(CCC=O)cc2c(c1O)C(=O)c1c(O)cc(OC)cc1C2=O

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

Other Identifiers

Properties
HBA: 16 RingCount: 5
HBD: 11 FractionCSP3: 0.41
AlogP: -0.79 Num_rotatable_bonds: 12
MolWt: 695.73 Num_heavy_atoms: 50
TPSA: 266.01 NumAromaticRings: 2

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
AD45248
Formula: C21H21O6N3

Smiles:
CNC(=N)NCc1c(CCC=O)cc2c(c1O)C(=O)c1c(O)cc(OC)cc1C2=O
HBA: 9 RingCount: 3
HBD: 5 FractionCSP3: 0.24
AlogP: 1.26 Num_rotatable_bonds: 6
MolWt: 411.41 Num_heavy_atoms: 30
TPSA: 148.81 NumAromaticRings: 2

Sugarmoiety
SD04299

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