Glycoside
...
GD125016

Name:
None

Formula:
C35H45O11N5

Smiles:
CNC(=N)NCc1c(CCCCO)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(CCCCO)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: 12 FractionCSP3: 0.46
AlogP: -0.61 Num_rotatable_bonds: 13
MolWt: 711.77 Num_heavy_atoms: 51
TPSA: 269.17 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
AD45597
Formula: C22H25O6N3

Smiles:
CNC(=N)NCc1c(CCCCO)cc2c(c1O)C(=O)c1c(O)cc(OC)cc1C2=O
HBA: 9 RingCount: 3
HBD: 6 FractionCSP3: 0.32
AlogP: 1.44 Num_rotatable_bonds: 7
MolWt: 427.46 Num_heavy_atoms: 31
TPSA: 151.97 NumAromaticRings: 2

Sugarmoiety
SD04299

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