Glycoside
...
GD157537

Name:
None

Formula:
C37H41O9N5

Smiles:
N=C(N)NCc1c(CCc2ccccc2)c2c(c(O)c1OC1OC(CO)C(O)C(O)C1OCCC1=CCNC(N)=C1)C(=O)c1ccccc1C2=O

Aglycone:
N=C(N)NCc1c(O)c(O)c2c(c1CCc1ccccc1)C(=O)c1ccccc1C2=O.NC1=CC(CCO)=CCN1

Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 14 RingCount: 6
HBD: 11 FractionCSP3: 0.32
AlogP: 0.86 Num_rotatable_bonds: 12
MolWt: 699.76 Num_heavy_atoms: 51
TPSA: 242.7 NumAromaticRings: 3

Unique Aglycone
AD51500
Formula: C7H12ON2

Smiles:
NC1=CC(CCO)=CCN1
HBA: 3 RingCount: 1
HBD: 4 FractionCSP3: 0.43
AlogP: -0.3 Num_rotatable_bonds: 2
MolWt: 140.19 Num_heavy_atoms: 10
TPSA: 58.28 NumAromaticRings: 0
AD57514
Formula: C24H21O4N3

Smiles:
N=C(N)NCc1c(O)c(O)c2c(c1CCc1ccccc1)C(=O)c1ccccc1C2=O
HBA: 7 RingCount: 4
HBD: 6 FractionCSP3: 0.12
AlogP: 2.64 Num_rotatable_bonds: 5
MolWt: 415.45 Num_heavy_atoms: 31
TPSA: 136.5 NumAromaticRings: 3

Sugarmoiety
SD00003

OCC1OC(O)C(O)C(O)C1O