Glycoside
...
GD115549

Name:
4-hydroxy-N-(4-{[1-hydroxy-3,5-dimethoxy-9-(4-methoxyphenyl)-10-phenyl-12-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-8-oxatricyclo[7.2.1.0²,⁷]dodeca-2,4,6-trien-11-yl]formamido}butyl)-2-methylbut-2-enamide

Formula:
C42H52O14N2

Smiles:
COc1ccc(C23Oc4cc(OC)cc(OC)c4C(O)(C(C(O)=NCCCCN=C(O)C(C)=CCO)C2c2ccccc2)C3OC2OC(CO)C(O)C(O)C2O)cc1

Aglycone:
COc1ccc(C23Oc4cc(OC)cc(OC)c4C(O)(C(C(O)=NCCCCN=C(O)C(C)=CCO)C2c2ccccc2)C3O)cc1

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

Other Identifiers

Properties
HBA: 16 RingCount: 6
HBD: 8 FractionCSP3: 0.48
AlogP: 2.42 Num_rotatable_bonds: 16
MolWt: 808.88 Num_heavy_atoms: 58
TPSA: 241.94 NumAromaticRings: 3

Unique Aglycone
AD45730
Formula: C36H42O9N2

Smiles:
COc1ccc(C23Oc4cc(OC)cc(OC)c4C(O)(C(C(O)=NCCCCN=C(O)C(C)=CCO)C2c2ccccc2)C3O)cc1
HBA: 11 RingCount: 5
HBD: 5 FractionCSP3: 0.39
AlogP: 4.59 Num_rotatable_bonds: 13
MolWt: 646.74 Num_heavy_atoms: 47
TPSA: 162.79 NumAromaticRings: 3

Sugarmoiety
SD00003

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